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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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