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

Systemtic Name: N-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-7-methyl-N-(phenylmethyl)thieno[2,3-b]quinoline-2-carboxamide Openeye Name: N-benzyl-N-[2-(cyclohexylamino)-2-oxo-ethyl]-7-methyl-thieno[2,3-b]quinoline-2-carboxamide CAS Name: N-[2-(cyclohexylamino)-2-oxoethyl]-7-methyl-N-(phenylmethyl)-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: N-benzyl-N-[2-(cyclohexylamino)-2-oxoethyl]-7-methylthieno[2,3-b]quinoline-2-carboxamide Traditional Name: N-benzyl-N-[2-(cyclohexylamino)-2-keto-ethyl]-7-methyl-thieno[2,3-b]quinoline-2-carboxamide Formula: C28H29N3O2S MolecularWeight: 471.61376

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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)NC5CCCCC5

Isomeric SMILES

CC1=CC2=NC3=C(C=C2C=C1)C=C(S3)C(=O)N(CC4=CC=CC=C4)CC(=O)NC5CCCCC5

InChI

InChI=1S/C28H29N3O2S/c1-19-12-13-21-15-22-16-25(34-27(22)30-24(21)14-19)28(33)31(17-20-8-4-2-5-9-20)18-26(32)29-23-10-6-3-7-11-23/h2,4-5,8-9,12-16,23H,3,6-7,10-11,17-18H2,1H3,(H,29,32)