N-[4-[2-[7-chloranyl-3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]phenyl]hexanamide

Systemtic Name: N-[4-[2-[7-chloranyl-3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]phenyl]hexanamide Openeye Name: N-[4-[2-[7-chloro-3-(o-tolyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]phenyl]hexanamide CAS Name: N-[4-[2-[[7-chloro-3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]phenyl]hexanamide IUPAC Name: N-[4-[2-[7-chloro-3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]phenyl]hexanamide Traditional Name: N-[4-[2-[[7-chloro-4-keto-3-(o-tolyl)quinazolin-2-yl]thio]acetyl]phenyl]hexanamide Formula: C29H28ClN3O3S MolecularWeight: 534.06892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=CC=C4C

Isomeric SMILES

CCCCCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=CC=C4C

InChI

InChI=1S/C29H28ClN3O3S/c1-3-4-5-10-27(35)31-22-14-11-20(12-15-22)26(34)18-37-29-32-24-17-21(30)13-16-23(24)28(36)33(29)25-9-7-6-8-19(25)2/h6-9,11-17H,3-5,10,18H2,1-2H3,(H,31,35)