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

Systemtic Name: N-[4-[2-[3-(3-chloranyl-4-methoxy-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]phenyl]hexanamide Openeye Name: N-[4-[2-[3-(3-chloro-4-methoxy-phenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]phenyl]hexanamide CAS Name: N-[4-[2-[[3-(3-chloro-4-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]phenyl]hexanamide IUPAC Name: N-[4-[2-[3-(3-chloro-4-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]phenyl]hexanamide Traditional Name: N-[4-[2-[[3-(3-chloro-4-methoxy-phenyl)-4-keto-quinazolin-2-yl]thio]acetyl]phenyl]hexanamide Formula: C29H28ClN3O4S MolecularWeight: 550.06832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CCCCCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C29H28ClN3O4S/c1-3-4-5-10-27(35)31-20-13-11-19(12-14-20)25(34)18-38-29-32-24-9-7-6-8-22(24)28(36)33(29)21-15-16-26(37-2)23(30)17-21/h6-9,11-17H,3-5,10,18H2,1-2H3,(H,31,35)