1-(4-methylpiperidin-1-yl)-2-[1-[(4-nitrophenyl)methyl]indol-3-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-methylpiperidin-1-yl)-2-[1-[(4-nitrophenyl)methyl]indol-3-yl]sulfanyl-ethanone Openeye Name: 1-(4-methyl-1-piperidyl)-2-[1-[(4-nitrophenyl)methyl]indol-3-yl]sulfanyl-ethanone CAS Name: 1-(4-methyl-1-piperidinyl)-2-[[1-[(4-nitrophenyl)methyl]-3-indolyl]thio]ethanone IUPAC Name: 1-(4-methylpiperidin-1-yl)-2-[1-[(4-nitrophenyl)methyl]indol-3-yl]sulfanylethanone Traditional Name: 1-(4-methylpiperidino)-2-[[1-(4-nitrobenzyl)indol-3-yl]thio]ethanone Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O3S/c1-17-10-12-24(13-11-17)23(27)16-30-22-15-25(21-5-3-2-4-20(21)22)14-18-6-8-19(9-7-18)26(28)29/h2-9,15,17H,10-14,16H2,1H3