(2R)-1-(2-methyl-5-nitro-3-phenyl-indol-1-yl)-3-phenylsulfanyl-propan-2-ol

Systemtic Name: (2R)-1-(2-methyl-5-nitro-3-phenyl-indol-1-yl)-3-phenylsulfanyl-propan-2-ol Openeye Name: (2R)-1-(2-methyl-5-nitro-3-phenyl-indol-1-yl)-3-phenylsulfanyl-propan-2-ol CAS Name: (2R)-1-(2-methyl-5-nitro-3-phenyl-1-indolyl)-3-(phenylthio)-2-propanol IUPAC Name: (2R)-1-(2-methyl-5-nitro-3-phenylindol-1-yl)-3-phenylsulfanylpropan-2-ol Traditional Name: (2R)-1-(2-methyl-5-nitro-3-phenyl-indol-1-yl)-3-(phenylthio)propan-2-ol Formula: C24H22N2O3S MolecularWeight: 418.50808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(CSC3=CC=CC=C3)O)C=CC(=C2)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(N1C[C@H](CSC3=CC=CC=C3)O)C=CC(=C2)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C24H22N2O3S/c1-17-24(18-8-4-2-5-9-18)22-14-19(26(28)29)12-13-23(22)25(17)15-20(27)16-30-21-10-6-3-7-11-21/h2-14,20,27H,15-16H2,1H3/t20-/m1/s1