5-[(5-chloranylthiophen-2-yl)methylamino]-1-ethyl-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: 5-[(5-chloranylthiophen-2-yl)methylamino]-1-ethyl-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: 5-[(5-chloro-2-thienyl)methylamino]-1-ethyl-N-(4-pyridylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: 5-[(5-chloro-2-thiophenyl)methylamino]-1-ethyl-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: 5-[(5-chlorothiophen-2-yl)methylamino]-1-ethyl-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: 5-[(5-chloro-2-thienyl)methylamino]-1-ethyl-N-(4-pyridylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C21H24ClN5OS MolecularWeight: 429.96616

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)NCC3=CC=C(S3)Cl)C(=N1)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

CCN1C2=C(CC(CC2)NCC3=CC=C(S3)Cl)C(=N1)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C21H24ClN5OS/c1-2-27-18-5-3-15(24-13-16-4-6-19(22)29-16)11-17(18)20(26-27)21(28)25-12-14-7-9-23-10-8-14/h4,6-10,15,24H,2-3,5,11-13H2,1H3,(H,25,28)