N-(cyclohexen-1-yl)-N-cyclopropyl-2-[3-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(cyclohexen-1-yl)-N-cyclopropyl-2-[3-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(cyclohexen-1-yl)-N-cyclopropyl-2-[3-(3-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(1-cyclohexenyl)-N-cyclopropyl-2-[[3-(3-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(cyclohexen-1-yl)-N-cyclopropyl-2-[3-(3-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[4-keto-3-(3-methoxyphenyl)quinazolin-2-yl]thio]acetamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(C4CC4)C5=CCCCC5

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(C4CC4)C5=CCCCC5

InChI

InChI=1S/C26H27N3O3S/c1-32-21-11-7-10-20(16-21)29-25(31)22-12-5-6-13-23(22)27-26(29)33-17-24(30)28(19-14-15-19)18-8-3-2-4-9-18/h5-8,10-13,16,19H,2-4,9,14-15,17H2,1H3