N-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[2-(dimethylamino)-2-oxo-ethyl]-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[2-(dimethylamino)-2-oxoethyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[2-(dimethylamino)-2-oxoethyl]-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[2-(dimethylamino)-2-keto-ethyl]-3-(2-thienyl)pyrazole-4-carboxamide Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CNC(=O)C1=CN(N=C1C2=CC=CS2)CC3=CC=CC=C3

Isomeric SMILES

CN(C)C(=O)CNC(=O)C1=CN(N=C1C2=CC=CS2)CC3=CC=CC=C3

InChI

InChI=1S/C19H20N4O2S/c1-22(2)17(24)11-20-19(25)15-13-23(12-14-7-4-3-5-8-14)21-18(15)16-9-6-10-26-16/h3-10,13H,11-12H2,1-2H3,(H,20,25)