2-chloro-6-methoxy-4-{[(5Z)-3-(4-methylphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl methanesulfonate

2-chloro-6-methoxy-4-{[(5Z)-3-(4-methylphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl methanesulfonate

Formula: C19H16ClNO5S3

SMILES: COC1=CC(C=C2/SC(=S)N(C2=O)C2=CC=C(C)C=C2)=CC(Cl)=C1OS(C)(=O)=O

IUPAC: 2-chloro-6-methoxy-4-{[(5Z)-3-(4-methylphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl methanesulfonate

InChI: InChI=1S/C19H16ClNO5S3/c1-11-4-6-13(7-5-11)21-18(22)16(28-19(21)27)10-12-8-14(20)17(15(9-12)25-2)26-29(3,23)24/h4-10H,1-3H3/b16-10-

Composition: C (48.56%), H (3.43%), Cl (7.54%), N (2.98%), O (17.02%), S (20.47%)

Molar Mass: 469.97

Atom Count: 45

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	468.9879138
Formal Charge	0
FSP3	0.16
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	KLJUMQHLTXGWFK-YBEGLDIGSA-N
Lipinski's Rule of Five	1
Molar Refractivity	119.93
Topological Polar Surface Area	72.91
Polarizability	46.96
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H16ClNO5S3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00