2-[(2-azanyl-2-methyl-propanoyl)amino]-N-[1-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-1-phenyl-ethyl]imidazol-4-yl]-4-phenyl-butanamide

Systemtic Name: 2-[(2-azanyl-2-methyl-propanoyl)amino]-N-[1-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-1-phenyl-ethyl]imidazol-4-yl]-4-phenyl-butanamide Openeye Name: 2-[(2-amino-2-methyl-propanoyl)amino]-N-[1-[2-(4-methyl-1-piperidyl)-2-oxo-1-phenyl-ethyl]imidazol-4-yl]-4-phenyl-butanamide CAS Name: 2-[(2-amino-2-methyl-1-oxopropyl)amino]-N-[1-[2-(4-methyl-1-piperidinyl)-2-oxo-1-phenylethyl]-4-imidazolyl]-4-phenylbutanamide IUPAC Name: 2-[(2-amino-2-methylpropanoyl)amino]-N-[1-[2-(4-methylpiperidin-1-yl)-2-oxo-1-phenylethyl]imidazol-4-yl]-4-phenylbutanamide Traditional Name: 2-[(2-amino-2-methyl-propanoyl)amino]-N-[1-[2-keto-2-(4-methylpiperidino)-1-phenyl-ethyl]imidazol-4-yl]-4-phenyl-butyramide Formula: C31H40N6O3 MolecularWeight: 544.6877

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(C2=CC=CC=C2)N3C=C(N=C3)NC(=O)C(CCC4=CC=CC=C4)NC(=O)C(C)(C)N

Isomeric SMILES

CC1CCN(CC1)C(=O)C(C2=CC=CC=C2)N3C=C(N=C3)NC(=O)C(CCC4=CC=CC=C4)NC(=O)C(C)(C)N

InChI

InChI=1S/C31H40N6O3/c1-22-16-18-36(19-17-22)29(39)27(24-12-8-5-9-13-24)37-20-26(33-21-37)35-28(38)25(34-30(40)31(2,3)32)15-14-23-10-6-4-7-11-23/h4-13,20-22,25,27H,14-19,32H2,1-3H3,(H,34,40)(H,35,38)