6-[5-methoxy-3-methyl-2-(4-phenylsulfanylphenyl)indol-1-yl]-1-pyrrolidin-1-yl-hexan-1-one

Systemtic Name: 6-[5-methoxy-3-methyl-2-(4-phenylsulfanylphenyl)indol-1-yl]-1-pyrrolidin-1-yl-hexan-1-one Openeye Name: 6-[5-methoxy-3-methyl-2-(4-phenylsulfanylphenyl)indol-1-yl]-1-pyrrolidin-1-yl-hexan-1-one CAS Name: 6-[5-methoxy-3-methyl-2-[4-(phenylthio)phenyl]-1-indolyl]-1-(1-pyrrolidinyl)-1-hexanone IUPAC Name: 6-[5-methoxy-3-methyl-2-(4-phenylsulfanylphenyl)indol-1-yl]-1-pyrrolidin-1-ylhexan-1-one Traditional Name: 6-[5-methoxy-3-methyl-2-[4-(phenylthio)phenyl]indol-1-yl]-1-pyrrolidino-hexan-1-one Formula: C32H36N2O2S MolecularWeight: 512.70544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)OC)CCCCCC(=O)N3CCCC3)C4=CC=C(C=C4)SC5=CC=CC=C5

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)OC)CCCCCC(=O)N3CCCC3)C4=CC=C(C=C4)SC5=CC=CC=C5

InChI

InChI=1S/C32H36N2O2S/c1-24-29-23-26(36-2)16-19-30(29)34(22-8-4-7-13-31(35)33-20-9-10-21-33)32(24)25-14-17-28(18-15-25)37-27-11-5-3-6-12-27/h3,5-6,11-12,14-19,23H,4,7-10,13,20-22H2,1-2H3