(3S,4S)-4-azanyl-5-[1-(2,4,6-trimethylphenyl)sulfonylindol-3-yl]pent-1-en-3-ol

Systemtic Name: (3S,4S)-4-azanyl-5-[1-(2,4,6-trimethylphenyl)sulfonylindol-3-yl]pent-1-en-3-ol Openeye Name: (3S,4S)-4-amino-5-[1-(2,4,6-trimethylphenyl)sulfonylindol-3-yl]pent-1-en-3-ol CAS Name: (3S,4S)-4-amino-5-[1-(2,4,6-trimethylphenyl)sulfonyl-3-indolyl]-1-penten-3-ol IUPAC Name: (3S,4S)-4-amino-5-[1-(2,4,6-trimethylphenyl)sulfonylindol-3-yl]pent-1-en-3-ol Traditional Name: (3S,4S)-4-amino-5-(1-mesitylsulfonylindol-3-yl)pent-1-en-3-ol Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C=C(C3=CC=CC=C32)CC(C(C=C)O)N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C=C(C3=CC=CC=C32)C[C@@H]([C@H](C=C)O)N)C

InChI

InChI=1S/C22H26N2O3S/c1-5-21(25)19(23)12-17-13-24(20-9-7-6-8-18(17)20)28(26,27)22-15(3)10-14(2)11-16(22)4/h5-11,13,19,21,25H,1,12,23H2,2-4H3/t19-,21-/m0/s1