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

Systemtic Name: N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[2-(isopropylamino)-2-oxo-ethyl]-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[2-(isopropylamino)-2-keto-ethyl]-3-(2-thienyl)pyrazole-4-carboxamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O2S/c1-14(2)22-18(25)11-21-20(26)16-13-24(12-15-7-4-3-5-8-15)23-19(16)17-9-6-10-27-17/h3-10,13-14H,11-12H2,1-2H3,(H,21,26)(H,22,25)