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

Systemtic Name: N-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[2-(diethylamino)-2-(3-thienyl)ethyl]pyrazole-4-carboxamide CAS Name: N-[2-(diethylamino)-2-(3-thiophenyl)ethyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[2-(diethylamino)-2-thiophen-3-ylethyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[2-(diethylamino)-2-(3-thienyl)ethyl]pyrazole-4-carboxamide Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=CN(N=C1)CC2=CC=CC=C2)C3=CSC=C3

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=CN(N=C1)CC2=CC=CC=C2)C3=CSC=C3

InChI

InChI=1S/C21H26N4OS/c1-3-24(4-2)20(18-10-11-27-16-18)13-22-21(26)19-12-23-25(15-19)14-17-8-6-5-7-9-17/h5-12,15-16,20H,3-4,13-14H2,1-2H3,(H,22,26)