(4S)-4-(1H-indol-3-ylmethyl)-2-methyl-3-(4-methylphenyl)sulfonyl-1,3,2-oxazaborolidin-5-one

Systemtic Name: (4S)-4-(1H-indol-3-ylmethyl)-2-methyl-3-(4-methylphenyl)sulfonyl-1,3,2-oxazaborolidin-5-one Openeye Name: (4S)-4-(1H-indol-3-ylmethyl)-2-methyl-3-(p-tolylsulfonyl)-1,3,2-oxazaborolidin-5-one CAS Name: (4S)-4-(1H-indol-3-ylmethyl)-2-methyl-3-(4-methylphenyl)sulfonyl-1,3,2-oxazaborolidin-5-one IUPAC Name: (4S)-4-(1H-indol-3-ylmethyl)-2-methyl-3-(4-methylphenyl)sulfonyl-1,3,2-oxazaborolidin-5-one Traditional Name: (4S)-4-(1H-indol-3-ylmethyl)-2-methyl-3-tosyl-1,3,2-oxazaborolidin-5-one Formula: C19H19BN2O4S MolecularWeight: 382.24116

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Descriptors Computed from Structure

Canonical SMILES:

B1(N(C(C(=O)O1)CC2=CNC3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)C)C

Isomeric SMILES

B1(N([C@H](C(=O)O1)CC2=CNC3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C19H19BN2O4S/c1-13-7-9-15(10-8-13)27(24,25)22-18(19(23)26-20(22)2)11-14-12-21-17-6-4-3-5-16(14)17/h3-10,12,18,21H,11H2,1-2H3/t18-/m0/s1