1-methyl-5-(3-oxidanylpropylamino)-N-phenethyl-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: 1-methyl-5-(3-oxidanylpropylamino)-N-phenethyl-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: 5-(3-hydroxypropylamino)-1-methyl-N-phenethyl-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: 5-(3-hydroxypropylamino)-1-methyl-N-phenethyl-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: 5-(3-hydroxypropylamino)-1-methyl-N-phenethyl-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: 5-(3-hydroxypropylamino)-1-methyl-N-phenethyl-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C20H28N4O2 MolecularWeight: 356.46192

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)NCCCO)C(=N1)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(CC(CC2)NCCCO)C(=N1)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H28N4O2/c1-24-18-9-8-16(21-11-5-13-25)14-17(18)19(23-24)20(26)22-12-10-15-6-3-2-4-7-15/h2-4,6-7,16,21,25H,5,8-14H2,1H3,(H,22,26)