N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-cyclopropyl-2-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]-N-p-anisyl-acetamide Formula: C28H27N3O3S MolecularWeight: 485.59728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(CC4=CC=C(C=C4)OC)C5CC5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(CC4=CC=C(C=C4)OC)C5CC5

InChI

InChI=1S/C28H27N3O3S/c1-19-7-11-22(12-8-19)31-27(33)24-5-3-4-6-25(24)29-28(31)35-18-26(32)30(21-13-14-21)17-20-9-15-23(34-2)16-10-20/h3-12,15-16,21H,13-14,17-18H2,1-2H3