2-azanyl-4,6-bis(chloranyl)-N-[(2S)-1-(3-cyanoindol-1-yl)butan-2-yl]benzenesulfonamide

Systemtic Name: 2-azanyl-4,6-bis(chloranyl)-N-[(2S)-1-(3-cyanoindol-1-yl)butan-2-yl]benzenesulfonamide Openeye Name: 2-amino-4,6-dichloro-N-[(1S)-1-[(3-cyanoindol-1-yl)methyl]propyl]benzenesulfonamide CAS Name: 2-amino-4,6-dichloro-N-[(2S)-1-(3-cyano-1-indolyl)butan-2-yl]benzenesulfonamide IUPAC Name: 2-amino-4,6-dichloro-N-[(2S)-1-(3-cyanoindol-1-yl)butan-2-yl]benzenesulfonamide Traditional Name: 2-amino-4,6-dichloro-N-[(1S)-1-[(3-cyanoindol-1-yl)methyl]propyl]benzenesulfonamide Formula: C19H18Cl2N4O2S MolecularWeight: 437.34282

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C=C(C2=CC=CC=C21)C#N)NS(=O)(=O)C3=C(C=C(C=C3N)Cl)Cl

Isomeric SMILES

CC[C@@H](CN1C=C(C2=CC=CC=C21)C#N)NS(=O)(=O)C3=C(C=C(C=C3N)Cl)Cl

InChI

InChI=1S/C19H18Cl2N4O2S/c1-2-14(11-25-10-12(9-22)15-5-3-4-6-18(15)25)24-28(26,27)19-16(21)7-13(20)8-17(19)23/h3-8,10,14,24H,2,11,23H2,1H3/t14-/m0/s1