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(5Z)-3-butyl-5-[(2E,4E)-5-[(4-methoxyphenyl)amino]penta-2,4-dien-1-ylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

(5Z)-3-butyl-5-[(2E,4E)-5-[(4-methoxyphenyl)amino]penta-2,4-dien-1-ylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Formula: C19H22N2O2S2

SMILES: CCCCN1C(=S)SC(=C/C=C/C=C/NC2=CC=C(OC)C=C2)C1=O

IUPAC: (5Z)-3-butyl-5-[(2E,4E)-5-[(4-methoxyphenyl)amino]penta-2,4-dien-1-ylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

InChI: InChI=1S/C19H22N2O2S2/c1-3-4-14-21-18(22)17(25-19(21)24)8-6-5-7-13-20-15-9-11-16(23-2)12-10-15/h5-13,20H,3-4,14H2,1-2H3/b6-5+,13-7+,17-8-

Composition: C (60.93%), H (5.92%), N (7.48%), O (8.54%), S (17.12%)

Molar Mass: 374.52

Atom Count: 47

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 374.112270304
Formal Charge 0
FSP3 0.26
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey BYQIFSQPWWZMGS-ICGSTPTISA-N
Lipinski's Rule of Five 1
Molar Refractivity 114.28
Topological Polar Surface Area 41.57
Polarizability 42.39
Ring Count 2
Rotatable Bond Count 8

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H22N2O2S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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