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

Systemtic Name: N-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-7-methyl-N-(phenylmethyl)thieno[2,3-b]quinoline-2-carboxamide Openeye Name: N-benzyl-N-[2-(cyclopentylamino)-2-oxo-ethyl]-7-methyl-thieno[2,3-b]quinoline-2-carboxamide CAS Name: N-[2-(cyclopentylamino)-2-oxoethyl]-7-methyl-N-(phenylmethyl)-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: N-benzyl-N-[2-(cyclopentylamino)-2-oxoethyl]-7-methylthieno[2,3-b]quinoline-2-carboxamide Traditional Name: N-benzyl-N-[2-(cyclopentylamino)-2-keto-ethyl]-7-methyl-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(CC4=CC=CC=C4)CC(=O)NC5CCCC5

Isomeric SMILES

CC1=CC2=NC3=C(C=C2C=C1)C=C(S3)C(=O)N(CC4=CC=CC=C4)CC(=O)NC5CCCC5

InChI

InChI=1S/C27H27N3O2S/c1-18-11-12-20-14-21-15-24(33-26(21)29-23(20)13-18)27(32)30(16-19-7-3-2-4-8-19)17-25(31)28-22-9-5-6-10-22/h2-4,7-8,11-15,22H,5-6,9-10,16-17H2,1H3,(H,28,31)