N-(diphenylmethyl)-2-[3-(2-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(diphenylmethyl)-2-[3-(2-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-benzhydryl-2-[3-(2-ethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(diphenylmethyl)-2-[[3-(2-ethoxyphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-benzhydryl-2-[3-(2-ethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-benzhydryl-2-[(4-keto-3-o-phenetyl-quinazolin-2-yl)thio]acetamide Formula: C31H27N3O3S MolecularWeight: 521.62938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H27N3O3S/c1-2-37-27-20-12-11-19-26(27)34-30(36)24-17-9-10-18-25(24)32-31(34)38-21-28(35)33-29(22-13-5-3-6-14-22)23-15-7-4-8-16-23/h3-20,29H,2,21H2,1H3,(H,33,35)