2-[3-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N,N-bis(phenylmethyl)ethanamide

Systemtic Name: 2-[3-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N,N-bis(phenylmethyl)ethanamide Openeye Name: N,N-dibenzyl-2-[3-(3-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[3-(3-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]-N,N-bis(phenylmethyl)acetamide IUPAC Name: N,N-dibenzyl-2-[3-(3-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N,N-dibenzyl-2-[[4-keto-3-(3-methoxyphenyl)quinazolin-2-yl]thio]acetamide Formula: C31H27N3O3S MolecularWeight: 521.62938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C31H27N3O3S/c1-37-26-16-10-15-25(19-26)34-30(36)27-17-8-9-18-28(27)32-31(34)38-22-29(35)33(20-23-11-4-2-5-12-23)21-24-13-6-3-7-14-24/h2-19H,20-22H2,1H3