6-[3-methyl-5-oxidanyl-2-[4-(phenylsulfinyl)phenyl]indol-1-yl]-1-pyrrolidin-1-yl-hexan-1-one

Systemtic Name: 6-[3-methyl-5-oxidanyl-2-[4-(phenylsulfinyl)phenyl]indol-1-yl]-1-pyrrolidin-1-yl-hexan-1-one Openeye Name: 6-[2-[4-(benzenesulfinyl)phenyl]-5-hydroxy-3-methyl-indol-1-yl]-1-pyrrolidin-1-yl-hexan-1-one CAS Name: 6-[2-[4-(benzenesulfinyl)phenyl]-5-hydroxy-3-methyl-1-indolyl]-1-(1-pyrrolidinyl)-1-hexanone IUPAC Name: 6-[2-[4-(benzenesulfinyl)phenyl]-5-hydroxy-3-methylindol-1-yl]-1-pyrrolidin-1-ylhexan-1-one Traditional Name: 6-[2-[4-(benzenesulfinyl)phenyl]-5-hydroxy-3-methyl-indol-1-yl]-1-pyrrolidino-hexan-1-one Formula: C31H34N2O3S MolecularWeight: 514.67826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H34N2O3S/c1-23-28-22-25(34)15-18-29(28)33(21-7-3-6-12-30(35)32-19-8-9-20-32)31(23)24-13-16-27(17-14-24)37(36)26-10-4-2-5-11-26/h2,4-5,10-11,13-18,22,34H,3,6-9,12,19-21H2,1H3