N-(1,3-benzodioxol-5-yl)-5-cyclopropyl-1-(2-methylphenyl)pyrazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-5-cyclopropyl-1-(2-methylphenyl)pyrazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-5-cyclopropyl-1-(o-tolyl)pyrazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-5-cyclopropyl-1-(2-methylphenyl)-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-5-cyclopropyl-1-(2-methylphenyl)pyrazole-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-5-cyclopropyl-1-(o-tolyl)pyrazole-4-carboxamide Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C=N2)C(=O)NC3=CC4=C(C=C3)OCO4)C5CC5

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C=N2)C(=O)NC3=CC4=C(C=C3)OCO4)C5CC5

InChI

InChI=1S/C21H19N3O3/c1-13-4-2-3-5-17(13)24-20(14-6-7-14)16(11-22-24)21(25)23-15-8-9-18-19(10-15)27-12-26-18/h2-5,8-11,14H,6-7,12H2,1H3,(H,23,25)