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

Systemtic Name: 4-tert-butyl-3-methoxy-N-[1-oxidanylidene-1-(phenylsulfonylamino)-2-(pyrazol-1-ylmethyl)pent-4-yn-2-yl]-N-(1,3-thiazol-2-yl)benzamide Openeye Name: N-[1-(benzenesulfonylcarbamoyl)-1-(pyrazol-1-ylmethyl)but-3-ynyl]-4-tert-butyl-3-methoxy-N-thiazol-2-yl-benzamide CAS Name: N-[1-(benzenesulfonamido)-1-oxo-2-(1-pyrazolylmethyl)pent-4-yn-2-yl]-4-tert-butyl-3-methoxy-N-(2-thiazolyl)benzamide IUPAC Name: N-[1-(benzenesulfonamido)-1-oxo-2-(pyrazol-1-ylmethyl)pent-4-yn-2-yl]-4-tert-butyl-3-methoxy-N-(1,3-thiazol-2-yl)benzamide Traditional Name: N-[1-(besylcarbamoyl)-1-(pyrazol-1-ylmethyl)but-3-ynyl]-4-tert-butyl-3-methoxy-N-thiazol-2-yl-benzamide Formula: C30H31N5O5S2 MolecularWeight: 605.72764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)N(C2=NC=CS2)C(CC#C)(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(C2=NC=CS2)C(CC#C)(CN3C=CC=N3)C(=O)NS(=O)(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C30H31N5O5S2/c1-6-15-30(21-34-18-10-16-32-34,27(37)33-42(38,39)23-11-8-7-9-12-23)35(28-31-17-19-41-28)26(36)22-13-14-24(29(2,3)4)25(20-22)40-5/h1,7-14,16-20H,15,21H2,2-5H3,(H,33,37)