1-methyl-5-[(phenylmethyl)amino]-N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: 1-methyl-5-[(phenylmethyl)amino]-N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: 5-(benzylamino)-1-methyl-N-(2-thienylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: 1-methyl-5-[(phenylmethyl)amino]-N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: 5-(benzylamino)-1-methyl-N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: 5-(benzylamino)-1-methyl-N-(2-thenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)NCC3=CC=CC=C3)C(=N1)C(=O)NCC4=CC=CS4

Isomeric SMILES

CN1C2=C(CC(CC2)NCC3=CC=CC=C3)C(=N1)C(=O)NCC4=CC=CS4

InChI

InChI=1S/C21H24N4OS/c1-25-19-10-9-16(22-13-15-6-3-2-4-7-15)12-18(19)20(24-25)21(26)23-14-17-8-5-11-27-17/h2-8,11,16,22H,9-10,12-14H2,1H3,(H,23,26)