N-ethyl-2-[(2Z)-2-[(4-iodophenyl)imino]-4-oxo-3-(prop-2-en-1-yl)-1,3-thiazolidin-5-yl]acetamide

N-ethyl-2-[(2Z)-2-[(4-iodophenyl)imino]-4-oxo-3-(prop-2-en-1-yl)-1,3-thiazolidin-5-yl]acetamide

Formula: C16H18IN3O2S

SMILES: CCNC(=O)CC1SC(=N/C2=CC=C(I)C=C2)N(CC=C)C1=O

IUPAC: N-ethyl-2-[(2Z)-2-[(4-iodophenyl)imino]-4-oxo-3-(prop-2-en-1-yl)-1,3-thiazolidin-5-yl]acetamide

InChI: InChI=1/C16H18IN3O2S/c1-3-9-20-15(22)13(10-14(21)18-4-2)23-16(20)19-12-7-5-11(17)6-8-12/h3,5-8,13H,1,4,9-10H2,2H3,(H,18,21)/b19-16-

Composition: C (43.35%), H (4.09%), I (28.63%), N (9.48%), O (7.22%), S (7.23%)

Molar Mass: 443.3

Atom Count: 41

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	443.01644
Formal Charge	0
FSP3	0.31
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	QQSUBXZIKUKPEK-MNDPQUGUNA-N
Lipinski's Rule of Five	1
Molar Refractivity	103.7
Topological Polar Surface Area	61.77
Polarizability	39.12
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H18IN3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00