methyl 3-[(2-chlorophenyl)methyl]-4-oxidanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazoline-7-carboxylate

Systemtic Name: methyl 3-[(2-chlorophenyl)methyl]-4-oxidanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazoline-7-carboxylate Openeye Name: methyl 3-[(2-chlorophenyl)methyl]-4-oxo-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-quinazoline-7-carboxylate CAS Name: 3-[(2-chlorophenyl)methyl]-4-oxo-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-chlorophenyl)methyl]-4-oxo-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylquinazoline-7-carboxylate Traditional Name: 3-(2-chlorobenzyl)-4-keto-2-[(2-keto-2-piperidino-ethyl)thio]quinazoline-7-carboxylic acid methyl ester Formula: C24H24ClN3O4S MolecularWeight: 485.98306

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC(=O)N3CCCCC3)CC4=CC=CC=C4Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC(=O)N3CCCCC3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C24H24ClN3O4S/c1-32-23(31)16-9-10-18-20(13-16)26-24(33-15-21(29)27-11-5-2-6-12-27)28(22(18)30)14-17-7-3-4-8-19(17)25/h3-4,7-10,13H,2,5-6,11-12,14-15H2,1H3