2-[1-(4-chlorophenyl)carbonyl-2-oxidanylidene-azepan-3-yl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one

Systemtic Name: 2-[1-(4-chlorophenyl)carbonyl-2-oxidanylidene-azepan-3-yl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one Openeye Name: 2-[1-(4-chlorobenzoyl)-2-oxo-azepan-3-yl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one CAS Name: 2-[[1-[(4-chlorophenyl)-oxomethyl]-2-oxo-3-azepanyl]thio]-3-(2-methoxyethyl)-4-quinazolinone IUPAC Name: 2-[1-(4-chlorobenzoyl)-2-oxoazepan-3-yl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one Traditional Name: 2-[[1-(4-chlorobenzoyl)-2-keto-azepan-3-yl]thio]-3-(2-methoxyethyl)quinazolin-4-one Formula: C24H24ClN3O4S MolecularWeight: 485.98306

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=CC=CC=C2N=C1SC3CCCCN(C3=O)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COCCN1C(=O)C2=CC=CC=C2N=C1SC3CCCCN(C3=O)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H24ClN3O4S/c1-32-15-14-28-22(30)18-6-2-3-7-19(18)26-24(28)33-20-8-4-5-13-27(23(20)31)21(29)16-9-11-17(25)12-10-16/h2-3,6-7,9-12,20H,4-5,8,13-15H2,1H3