N-cyano-1-[3-methyl-3-[[2-oxidanyl-2-[3-(phenylsulfonylamino)phenyl]ethyl]amino]butyl]indole-5-carboxamide

Systemtic Name: N-cyano-1-[3-methyl-3-[[2-oxidanyl-2-[3-(phenylsulfonylamino)phenyl]ethyl]amino]butyl]indole-5-carboxamide Openeye Name: 1-[3-[[2-[3-(benzenesulfonamido)phenyl]-2-hydroxy-ethyl]amino]-3-methyl-butyl]-N-cyano-indole-5-carboxamide CAS Name: 1-[3-[[2-[3-(benzenesulfonamido)phenyl]-2-hydroxyethyl]amino]-3-methylbutyl]-N-cyano-5-indolecarboxamide IUPAC Name: 1-[3-[[2-[3-(benzenesulfonamido)phenyl]-2-hydroxyethyl]amino]-3-methylbutyl]-N-cyanoindole-5-carboxamide Traditional Name: 1-[3-[[2-[3-(benzenesulfonamido)phenyl]-2-hydroxy-ethyl]amino]-3-methyl-butyl]-N-cyano-indole-5-carboxamide Formula: C29H31N5O4S MolecularWeight: 545.65254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1C=CC2=C1C=CC(=C2)C(=O)NC#N)NCC(C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4)O

Isomeric SMILES

CC(C)(CCN1C=CC2=C1C=CC(=C2)C(=O)NC#N)NCC(C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C29H31N5O4S/c1-29(2,14-16-34-15-13-21-17-23(11-12-26(21)34)28(36)31-20-30)32-19-27(35)22-7-6-8-24(18-22)33-39(37,38)25-9-4-3-5-10-25/h3-13,15,17-18,27,32-33,35H,14,16,19H2,1-2H3,(H,31,36)