3-(3-methoxyphenyl)-N-methyl-2-[(3-methylphenyl)methylsulfanyl]-4-oxidanylidene-N-(phenylmethyl)quinazoline-7-carboxamide

Systemtic Name: 3-(3-methoxyphenyl)-N-methyl-2-[(3-methylphenyl)methylsulfanyl]-4-oxidanylidene-N-(phenylmethyl)quinazoline-7-carboxamide Openeye Name: N-benzyl-3-(3-methoxyphenyl)-N-methyl-2-(m-tolylmethylsulfanyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 3-(3-methoxyphenyl)-N-methyl-2-[(3-methylphenyl)methylthio]-4-oxo-N-(phenylmethyl)-7-quinazolinecarboxamide IUPAC Name: N-benzyl-3-(3-methoxyphenyl)-N-methyl-2-[(3-methylphenyl)methylsulfanyl]-4-oxoquinazoline-7-carboxamide Traditional Name: N-benzyl-4-keto-3-(3-methoxyphenyl)-N-methyl-2-[(3-methylbenzyl)thio]quinazoline-7-carboxamide Formula: C32H29N3O3S MolecularWeight: 535.65596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NC3=C(C=CC(=C3)C(=O)N(C)CC4=CC=CC=C4)C(=O)N2C5=CC(=CC=C5)OC

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NC3=C(C=CC(=C3)C(=O)N(C)CC4=CC=CC=C4)C(=O)N2C5=CC(=CC=C5)OC

InChI

InChI=1S/C32H29N3O3S/c1-22-9-7-12-24(17-22)21-39-32-33-29-18-25(30(36)34(2)20-23-10-5-4-6-11-23)15-16-28(29)31(37)35(32)26-13-8-14-27(19-26)38-3/h4-19H,20-21H2,1-3H3