2-[2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-N-[(4-methylphenyl)methyl]benzamide

Systemtic Name: 2-[2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-N-[(4-methylphenyl)methyl]benzamide Openeye Name: 2-[[2-(3,6-dimethyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-N-(p-tolylmethyl)benzamide CAS Name: 2-[[2-[(3,6-dimethyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]amino]-N-[(4-methylphenyl)methyl]benzamide IUPAC Name: 2-[[2-(3,6-dimethyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]-N-[(4-methylphenyl)methyl]benzamide Traditional Name: 2-[[2-[(4-keto-3,6-dimethyl-quinazolin-2-yl)thio]acetyl]amino]-N-(4-methylbenzyl)benzamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=O)CSC3=NC4=C(C=C(C=C4)C)C(=O)N3C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=O)CSC3=NC4=C(C=C(C=C4)C)C(=O)N3C

InChI

InChI=1S/C27H26N4O3S/c1-17-8-11-19(12-9-17)15-28-25(33)20-6-4-5-7-22(20)29-24(32)16-35-27-30-23-13-10-18(2)14-21(23)26(34)31(27)3/h4-14H,15-16H2,1-3H3,(H,28,33)(H,29,32)