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

Systemtic Name: N-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-N-(furan-2-ylmethyl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide Openeye Name: N-[2-(cyclohexylamino)-2-oxo-ethyl]-N-(2-furylmethyl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide CAS Name: N-[2-(cyclohexylamino)-2-oxoethyl]-N-(2-furanylmethyl)-7-methyl-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: N-[2-(cyclohexylamino)-2-oxoethyl]-N-(furan-2-ylmethyl)-7-methylthieno[2,3-b]quinoline-2-carboxamide Traditional Name: N-[2-(cyclohexylamino)-2-keto-ethyl]-N-(2-furfuryl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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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=CO4)CC(=O)NC5CCCCC5

Isomeric SMILES

CC1=CC2=NC3=C(C=C2C=C1)C=C(S3)C(=O)N(CC4=CC=CO4)CC(=O)NC5CCCCC5

InChI

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