N-[2-[3-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-4-methyl-benzamide

Systemtic Name: N-[2-[3-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-4-methyl-benzamide Openeye Name: N-[2-[3-[2-(cyclopentylamino)-2-oxo-ethyl]sulfanylindol-1-yl]ethyl]-4-methyl-benzamide CAS Name: N-[2-[3-[[2-(cyclopentylamino)-2-oxoethyl]thio]-1-indolyl]ethyl]-4-methylbenzamide IUPAC Name: N-[2-[3-[2-(cyclopentylamino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-methylbenzamide Traditional Name: N-[2-[3-[[2-(cyclopentylamino)-2-keto-ethyl]thio]indol-1-yl]ethyl]-4-methyl-benzamide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O2S/c1-18-10-12-19(13-11-18)25(30)26-14-15-28-16-23(21-8-4-5-9-22(21)28)31-17-24(29)27-20-6-2-3-7-20/h4-5,8-13,16,20H,2-3,6-7,14-15,17H2,1H3,(H,26,30)(H,27,29)