N,N-dicyclohexyl-2-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N,N-dicyclohexyl-2-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N,N-dicyclohexyl-2-[3-(o-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N,N-dicyclohexyl-2-[[3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N,N-dicyclohexyl-2-[3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N,N-dicyclohexyl-2-[[4-keto-3-(o-tolyl)quinazolin-2-yl]thio]acetamide Formula: C29H35N3O2S MolecularWeight: 489.6721

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(C4CCCCC4)C5CCCCC5

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(C4CCCCC4)C5CCCCC5

InChI

InChI=1S/C29H35N3O2S/c1-21-12-8-11-19-26(21)32-28(34)24-17-9-10-18-25(24)30-29(32)35-20-27(33)31(22-13-4-2-5-14-22)23-15-6-3-7-16-23/h8-12,17-19,22-23H,2-7,13-16,20H2,1H3