N-(cyclopentylcarbamoyl)-2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(cyclopentylcarbamoyl)-2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(cyclopentylcarbamoyl)-2-(3-methyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[(cyclopentylamino)-oxomethyl]-2-[(3-methyl-4-oxo-2-benzo[g]quinazolinyl)thio]acetamide IUPAC Name: N-(cyclopentylcarbamoyl)-2-(3-methyl-4-oxobenzo[g]quinazolin-2-yl)sulfanylacetamide Traditional Name: N-(cyclopentylcarbamoyl)-2-[(4-keto-3-methyl-benzo[g]quinazolin-2-yl)thio]acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC(=O)NC(=O)NC4CCCC4

Isomeric SMILES

CN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC(=O)NC(=O)NC4CCCC4

InChI

InChI=1S/C21H22N4O3S/c1-25-19(27)16-10-13-6-2-3-7-14(13)11-17(16)23-21(25)29-12-18(26)24-20(28)22-15-8-4-5-9-15/h2-3,6-7,10-11,15H,4-5,8-9,12H2,1H3,(H2,22,24,26,28)