3-(3,5-dimethylphenyl)-N-methyl-4-oxidanylidene-N-(phenylmethyl)-2-(phenylmethylsulfanyl)quinazoline-7-carboxamide

Systemtic Name: 3-(3,5-dimethylphenyl)-N-methyl-4-oxidanylidene-N-(phenylmethyl)-2-(phenylmethylsulfanyl)quinazoline-7-carboxamide Openeye Name: N-benzyl-2-benzylsulfanyl-3-(3,5-dimethylphenyl)-N-methyl-4-oxo-quinazoline-7-carboxamide CAS Name: 3-(3,5-dimethylphenyl)-N-methyl-4-oxo-N-(phenylmethyl)-2-(phenylmethylthio)-7-quinazolinecarboxamide IUPAC Name: N-benzyl-2-benzylsulfanyl-3-(3,5-dimethylphenyl)-N-methyl-4-oxoquinazoline-7-carboxamide Traditional Name: N-benzyl-2-(benzylthio)-3-(3,5-dimethylphenyl)-4-keto-N-methyl-quinazoline-7-carboxamide Formula: C32H29N3O2S MolecularWeight: 519.65656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)N(C)CC4=CC=CC=C4)N=C2SCC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)N(C)CC4=CC=CC=C4)N=C2SCC5=CC=CC=C5)C

InChI

InChI=1S/C32H29N3O2S/c1-22-16-23(2)18-27(17-22)35-31(37)28-15-14-26(30(36)34(3)20-24-10-6-4-7-11-24)19-29(28)33-32(35)38-21-25-12-8-5-9-13-25/h4-19H,20-21H2,1-3H3