4-methyl-N-[(1S)-3-[4-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)piperidin-1-yl]-1-phenyl-butyl]piperazine-1-carboxamide

Systemtic Name: 4-methyl-N-[(1S)-3-[4-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)piperidin-1-yl]-1-phenyl-butyl]piperazine-1-carboxamide Openeye Name: N-[(1S)-3-[4-(3-isopropyl-5-methyl-1,2,4-triazol-4-yl)-1-piperidyl]-1-phenyl-butyl]-4-methyl-piperazine-1-carboxamide CAS Name: 4-methyl-N-[(1S)-3-[4-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)-1-piperidinyl]-1-phenylbutyl]-1-piperazinecarboxamide IUPAC Name: 4-methyl-N-[(1S)-3-[4-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)piperidin-1-yl]-1-phenylbutyl]piperazine-1-carboxamide Traditional Name: N-[(1S)-3-[4-(3-isopropyl-5-methyl-1,2,4-triazol-4-yl)piperidino]-1-phenyl-butyl]-4-methyl-piperazine-1-carboxamide Formula: C27H43N7O MolecularWeight: 481.67662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCN(CC2)C(C)CC(C3=CC=CC=C3)NC(=O)N4CCN(CC4)C)C(C)C

Isomeric SMILES

CC1=NN=C(N1C2CCN(CC2)C(C)C[C@@H](C3=CC=CC=C3)NC(=O)N4CCN(CC4)C)C(C)C

InChI

InChI=1S/C27H43N7O/c1-20(2)26-30-29-22(4)34(26)24-11-13-32(14-12-24)21(3)19-25(23-9-7-6-8-10-23)28-27(35)33-17-15-31(5)16-18-33/h6-10,20-21,24-25H,11-19H2,1-5H3,(H,28,35)/t21?,25-/m0/s1