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(5E)-5-{[4-(dimethylamino)phenyl]methylidene}-3-phenyl-2-sulfanylideneimidazolidin-4-one

(5E)-5-{[4-(dimethylamino)phenyl]methylidene}-3-phenyl-2-sulfanylideneimidazolidin-4-one

CAS: 301343-54-4

Formula: C18H17N3OS

SMILES: CN(C)C1=CC=C(C=C2NC(=S)N(C2=O)C2=CC=CC=C2)C=C1

IUPAC: (5E)-5-{[4-(dimethylamino)phenyl]methylidene}-3-phenyl-2-sulfanylideneimidazolidin-4-one

InChI: InChI=1S/C18H17N3OS/c1-20(2)14-10-8-13(9-11-14)12-16-17(22)21(18(23)19-16)15-6-4-3-5-7-15/h3-12H,1-2H3,(H,19,23)/b16-12+

Composition: C (66.85%), H (5.30%), N (12.99%), O (4.95%), S (9.91%)

Molar Mass: 323.41

Atom Count: 40

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 323.109233353
Formal Charge 0
FSP3 0.11
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey ANHDDOVYDLLMCS-FOWTUZBSSA-N
Lipinski's Rule of Five 1
Molar Refractivity 98.82
Topological Polar Surface Area 35.58
Polarizability 36.93
Ring Count 3
Rotatable Bond Count 3

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