azepan-1-yl-[1-ethyl-5-(3-methylbutylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone

Systemtic Name: azepan-1-yl-[1-ethyl-5-(3-methylbutylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone Openeye Name: azepan-1-yl-[1-ethyl-5-(isopentylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone CAS Name: 1-azepanyl-[1-ethyl-5-(3-methylbutylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone IUPAC Name: azepan-1-yl-[1-ethyl-5-(3-methylbutylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone Traditional Name: azepan-1-yl-[1-ethyl-5-(isoamylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone Formula: C21H36N4O MolecularWeight: 360.53674

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)NCCC(C)C)C(=N1)C(=O)N3CCCCCC3

Isomeric SMILES

CCN1C2=C(CC(CC2)NCCC(C)C)C(=N1)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H36N4O/c1-4-25-19-10-9-17(22-12-11-16(2)3)15-18(19)20(23-25)21(26)24-13-7-5-6-8-14-24/h16-17,22H,4-15H2,1-3H3