3-(1H-benzimidazol-2-yl)-1-[(3S)-3-[methyl(phenethyl)amino]piperidin-1-yl]propan-1-one

Systemtic Name: 3-(1H-benzimidazol-2-yl)-1-[(3S)-3-[methyl(phenethyl)amino]piperidin-1-yl]propan-1-one Openeye Name: 3-(1H-benzimidazol-2-yl)-1-[(3S)-3-[methyl(phenethyl)amino]-1-piperidyl]propan-1-one CAS Name: 3-(1H-benzimidazol-2-yl)-1-[(3S)-3-[methyl(phenethyl)amino]-1-piperidinyl]-1-propanone IUPAC Name: 3-(1H-benzimidazol-2-yl)-1-[(3S)-3-[methyl(phenethyl)amino]piperidin-1-yl]propan-1-one Traditional Name: 3-(1H-benzimidazol-2-yl)-1-[(3S)-3-[methyl(phenethyl)amino]piperidino]propan-1-one Formula: C24H30N4O MolecularWeight: 390.5212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C2CCCN(C2)C(=O)CCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CN(CCC1=CC=CC=C1)[C@H]2CCCN(C2)C(=O)CCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C24H30N4O/c1-27(17-15-19-8-3-2-4-9-19)20-10-7-16-28(18-20)24(29)14-13-23-25-21-11-5-6-12-22(21)26-23/h2-6,8-9,11-12,20H,7,10,13-18H2,1H3,(H,25,26)/t20-/m0/s1