[1-ethyl-5-(quinolin-3-ylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-ethyl-5-(quinolin-3-ylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-piperidin-1-yl-methanone Openeye Name: [1-ethyl-5-(3-quinolylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-(1-piperidyl)methanone CAS Name: [1-ethyl-5-(3-quinolinylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-(1-piperidinyl)methanone IUPAC Name: [1-ethyl-5-(quinolin-3-ylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-piperidin-1-ylmethanone Traditional Name: [1-ethyl-5-(3-quinolylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]-piperidino-methanone Formula: C25H31N5O MolecularWeight: 417.54654

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)NCC3=CC4=CC=CC=C4N=C3)C(=N1)C(=O)N5CCCCC5

Isomeric SMILES

CCN1C2=C(CC(CC2)NCC3=CC4=CC=CC=C4N=C3)C(=N1)C(=O)N5CCCCC5

InChI

InChI=1S/C25H31N5O/c1-2-30-23-11-10-20(26-16-18-14-19-8-4-5-9-22(19)27-17-18)15-21(23)24(28-30)25(31)29-12-6-3-7-13-29/h4-5,8-9,14,17,20,26H,2-3,6-7,10-13,15-16H2,1H3