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

Systemtic Name: 5-(1-benzothiophen-2-ylmethylamino)-1-ethyl-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: 5-(benzothiophen-2-ylmethylamino)-1-ethyl-N-(4-pyridylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: 5-(1-benzothiophen-2-ylmethylamino)-1-ethyl-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: 5-(1-benzothiophen-2-ylmethylamino)-1-ethyl-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: 5-(benzothiophen-2-ylmethylamino)-1-ethyl-N-(4-pyridylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C25H27N5OS MolecularWeight: 445.57978

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)NCC3=CC4=CC=CC=C4S3)C(=N1)C(=O)NCC5=CC=NC=C5

Isomeric SMILES

CCN1C2=C(CC(CC2)NCC3=CC4=CC=CC=C4S3)C(=N1)C(=O)NCC5=CC=NC=C5

InChI

InChI=1S/C25H27N5OS/c1-2-30-22-8-7-19(27-16-20-13-18-5-3-4-6-23(18)32-20)14-21(22)24(29-30)25(31)28-15-17-9-11-26-12-10-17/h3-6,9-13,19,27H,2,7-8,14-16H2,1H3,(H,28,31)