4-tert-butyl-N-[4-cyano-1-oxidanylidene-1-(phenylsulfonylamino)-2-(pyrazol-1-ylmethyl)butan-2-yl]-3-methoxy-N-(1,3-thiazol-2-ylmethyl)benzamide

Systemtic Name: 4-tert-butyl-N-[4-cyano-1-oxidanylidene-1-(phenylsulfonylamino)-2-(pyrazol-1-ylmethyl)butan-2-yl]-3-methoxy-N-(1,3-thiazol-2-ylmethyl)benzamide Openeye Name: N-[1-(benzenesulfonylcarbamoyl)-3-cyano-1-(pyrazol-1-ylmethyl)propyl]-4-tert-butyl-3-methoxy-N-(thiazol-2-ylmethyl)benzamide CAS Name: N-[1-(benzenesulfonamido)-4-cyano-1-oxo-2-(1-pyrazolylmethyl)butan-2-yl]-4-tert-butyl-3-methoxy-N-(2-thiazolylmethyl)benzamide IUPAC Name: N-[1-(benzenesulfonamido)-4-cyano-1-oxo-2-(pyrazol-1-ylmethyl)butan-2-yl]-4-tert-butyl-3-methoxy-N-(1,3-thiazol-2-ylmethyl)benzamide Traditional Name: N-[1-(besylcarbamoyl)-3-cyano-1-(pyrazol-1-ylmethyl)propyl]-4-tert-butyl-3-methoxy-N-(thiazol-2-ylmethyl)benzamide Formula: C31H34N6O5S2 MolecularWeight: 634.76886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)N(CC2=NC=CS2)C(CCC#N)(CN3C=CC=N3)C(=O)NS(=O)(=O)C4=CC=CC=C4)OC

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)N(CC2=NC=CS2)C(CCC#N)(CN3C=CC=N3)C(=O)NS(=O)(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C31H34N6O5S2/c1-30(2,3)25-13-12-23(20-26(25)42-4)28(38)37(21-27-33-17-19-43-27)31(14-8-15-32,22-36-18-9-16-34-36)29(39)35-44(40,41)24-10-6-5-7-11-24/h5-7,9-13,16-20H,8,14,21-22H2,1-4H3,(H,35,39)