1-methyl-5-(pyridin-4-ylmethylamino)-N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: 1-methyl-5-(pyridin-4-ylmethylamino)-N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: 1-methyl-5-(4-pyridylmethylamino)-N-(2-thienylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: 1-methyl-5-(pyridin-4-ylmethylamino)-N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: 1-methyl-5-(pyridin-4-ylmethylamino)-N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: 1-methyl-5-(4-pyridylmethylamino)-N-(2-thenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C20H23N5OS MolecularWeight: 381.49452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5OS/c1-25-18-5-4-15(22-12-14-6-8-21-9-7-14)11-17(18)19(24-25)20(26)23-13-16-3-2-10-27-16/h2-3,6-10,15,22H,4-5,11-13H2,1H3,(H,23,26)