N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-3-(prop-2-ynylsulfamoyl)benzamide

Systemtic Name: N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-3-(prop-2-ynylsulfamoyl)benzamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-3-(prop-2-ynylsulfamoyl)benzamide CAS Name: N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-3-(prop-2-ynylsulfamoyl)benzamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-3-(prop-2-ynylsulfamoyl)benzamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-3-(propargylsulfamoyl)benzamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC#C

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC#C

InChI

InChI=1S/C22H22N4O3S/c1-3-12-24-30(28,29)21-11-7-10-20(13-21)22(27)25(2)15-19-14-23-26(17-19)16-18-8-5-4-6-9-18/h1,4-11,13-14,17,24H,12,15-16H2,2H3