5-chloranyl-1,3-dimethyl-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-1,3-dimethyl-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]pyrazole-4-carboxamide Openeye Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-5-chloro-1,3-dimethyl-pyrazole-4-carboxamide CAS Name: 5-chloro-1,3-dimethyl-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]-4-pyrazolecarboxamide IUPAC Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-5-chloro-1,3-dimethylpyrazole-4-carboxamide Traditional Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-5-chloro-1,3-dimethyl-pyrazole-4-carboxamide Formula: C20H22ClN5O MolecularWeight: 383.87458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2CCCC3=C2C=NN3CC4=CC=CC=C4)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2CCCC3=C2C=NN3CC4=CC=CC=C4)Cl)C

InChI

InChI=1S/C20H22ClN5O/c1-13-18(19(21)25(2)24-13)20(27)23-16-9-6-10-17-15(16)11-22-26(17)12-14-7-4-3-5-8-14/h3-5,7-8,11,16H,6,9-10,12H2,1-2H3,(H,23,27)