N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-propylsulfonyl-benzamide

Systemtic Name: N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-propylsulfonyl-benzamide Openeye Name: N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-propylsulfonyl-benzamide CAS Name: N-methyl-N-[(1-methyl-4-pyrazolyl)methyl]-2-propylsulfonylbenzamide IUPAC Name: N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-propylsulfonylbenzamide Traditional Name: N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-propylsulfonyl-benzamide Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=CC=C1C(=O)N(C)CC2=CN(N=C2)C

Isomeric SMILES

CCCS(=O)(=O)C1=CC=CC=C1C(=O)N(C)CC2=CN(N=C2)C

InChI

InChI=1S/C16H21N3O3S/c1-4-9-23(21,22)15-8-6-5-7-14(15)16(20)18(2)11-13-10-17-19(3)12-13/h5-8,10,12H,4,9,11H2,1-3H3