N-(6-methoxypyridin-3-yl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-(6-methoxypyridin-3-yl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(6-methoxy-3-pyridyl)-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-(6-methoxy-3-pyridinyl)-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(6-methoxypyridin-3-yl)-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(6-methoxy-3-pyridyl)-3-(2-thienyl)pyrazole-4-carboxamide Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

COC1=NC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C21H18N4O2S/c1-27-19-10-9-16(12-22-19)23-21(26)17-14-25(13-15-6-3-2-4-7-15)24-20(17)18-8-5-11-28-18/h2-12,14H,13H2,1H3,(H,23,26)