N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: 2-(4-methoxyphenyl)-N-piperonyl-5-(2-thienyl)pyrazole-3-carboxamide Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H19N3O4S/c1-28-17-7-5-16(6-8-17)26-19(12-18(25-26)22-3-2-10-31-22)23(27)24-13-15-4-9-20-21(11-15)30-14-29-20/h2-12H,13-14H2,1H3,(H,24,27)