2-azanyl-3-(4-chlorophenyl)-1-[4-cyclohexyl-4-(1,2,3-triazol-1-ylmethyl)piperidin-1-yl]propan-1-one

Systemtic Name: 2-azanyl-3-(4-chlorophenyl)-1-[4-cyclohexyl-4-(1,2,3-triazol-1-ylmethyl)piperidin-1-yl]propan-1-one Openeye Name: 2-amino-3-(4-chlorophenyl)-1-[4-cyclohexyl-4-(triazol-1-ylmethyl)-1-piperidyl]propan-1-one CAS Name: 2-amino-3-(4-chlorophenyl)-1-[4-cyclohexyl-4-(1-triazolylmethyl)-1-piperidinyl]-1-propanone IUPAC Name: 2-amino-3-(4-chlorophenyl)-1-[4-cyclohexyl-4-(triazol-1-ylmethyl)piperidin-1-yl]propan-1-one Traditional Name: 2-amino-3-(4-chlorophenyl)-1-[4-cyclohexyl-4-(triazol-1-ylmethyl)piperidino]propan-1-one Formula: C23H32ClN5O MolecularWeight: 429.98608

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2(CCN(CC2)C(=O)C(CC3=CC=C(C=C3)Cl)N)CN4C=CN=N4

Isomeric SMILES

C1CCC(CC1)C2(CCN(CC2)C(=O)C(CC3=CC=C(C=C3)Cl)N)CN4C=CN=N4

InChI

InChI=1S/C23H32ClN5O/c24-20-8-6-18(7-9-20)16-21(25)22(30)28-13-10-23(11-14-28,17-29-15-12-26-27-29)19-4-2-1-3-5-19/h6-9,12,15,19,21H,1-5,10-11,13-14,16-17,25H2