N-[2-[3-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-3,5-dimethyl-benzamide

Systemtic Name: N-[2-[3-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-3,5-dimethyl-benzamide Openeye Name: N-[2-[3-[2-(cyclopentylamino)-2-oxo-ethyl]sulfanylindol-1-yl]ethyl]-3,5-dimethyl-benzamide CAS Name: N-[2-[3-[[2-(cyclopentylamino)-2-oxoethyl]thio]-1-indolyl]ethyl]-3,5-dimethylbenzamide IUPAC Name: N-[2-[3-[2-(cyclopentylamino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-3,5-dimethylbenzamide Traditional Name: N-[2-[3-[[2-(cyclopentylamino)-2-keto-ethyl]thio]indol-1-yl]ethyl]-3,5-dimethyl-benzamide Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)NC4CCCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)NC4CCCC4)C

InChI

InChI=1S/C26H31N3O2S/c1-18-13-19(2)15-20(14-18)26(31)27-11-12-29-16-24(22-9-5-6-10-23(22)29)32-17-25(30)28-21-7-3-4-8-21/h5-6,9-10,13-16,21H,3-4,7-8,11-12,17H2,1-2H3,(H,27,31)(H,28,30)