2-methyl-5-oxidanyl-N-[1-(2-phenylsulfanylethyl)piperidin-4-yl]-1H-indole-3-carboxamide

Systemtic Name: 2-methyl-5-oxidanyl-N-[1-(2-phenylsulfanylethyl)piperidin-4-yl]-1H-indole-3-carboxamide Openeye Name: 5-hydroxy-2-methyl-N-[1-(2-phenylsulfanylethyl)-4-piperidyl]-1H-indole-3-carboxamide CAS Name: 5-hydroxy-2-methyl-N-[1-[2-(phenylthio)ethyl]-4-piperidinyl]-1H-indole-3-carboxamide IUPAC Name: 5-hydroxy-2-methyl-N-[1-(2-phenylsulfanylethyl)piperidin-4-yl]-1H-indole-3-carboxamide Traditional Name: 5-hydroxy-2-methyl-N-[1-[2-(phenylthio)ethyl]-4-piperidyl]-1H-indole-3-carboxamide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)O)C(=O)NC3CCN(CC3)CCSC4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)O)C(=O)NC3CCN(CC3)CCSC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O2S/c1-16-22(20-15-18(27)7-8-21(20)24-16)23(28)25-17-9-11-26(12-10-17)13-14-29-19-5-3-2-4-6-19/h2-8,15,17,24,27H,9-14H2,1H3,(H,25,28)