N-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-7-methyl-N-(2-methylphenyl)thieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: N-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-7-methyl-N-(2-methylphenyl)thieno[2,3-b]quinoline-2-carboxamide Openeye Name: N-[2-(cyclopentylamino)-2-oxo-ethyl]-7-methyl-N-(o-tolyl)thieno[2,3-b]quinoline-2-carboxamide CAS Name: N-[2-(cyclopentylamino)-2-oxoethyl]-7-methyl-N-(2-methylphenyl)-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: N-[2-(cyclopentylamino)-2-oxoethyl]-7-methyl-N-(2-methylphenyl)thieno[2,3-b]quinoline-2-carboxamide Traditional Name: N-[2-(cyclopentylamino)-2-keto-ethyl]-7-methyl-N-(o-tolyl)thieno[2,3-b]quinoline-2-carboxamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC3=C(C=C2C=C1)C=C(S3)C(=O)N(CC(=O)NC4CCCC4)C5=CC=CC=C5C

Isomeric SMILES

CC1=CC2=NC3=C(C=C2C=C1)C=C(S3)C(=O)N(CC(=O)NC4CCCC4)C5=CC=CC=C5C

InChI

InChI=1S/C27H27N3O2S/c1-17-11-12-19-14-20-15-24(33-26(20)29-22(19)13-17)27(32)30(23-10-6-3-7-18(23)2)16-25(31)28-21-8-4-5-9-21/h3,6-7,10-15,21H,4-5,8-9,16H2,1-2H3,(H,28,31)