3-ethyl-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-6-(2-methoxyethanoylamino)-N-methyl-2-pyridin-3-yl-benzimidazole-4-carboxamide

Systemtic Name: 3-ethyl-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-6-(2-methoxyethanoylamino)-N-methyl-2-pyridin-3-yl-benzimidazole-4-carboxamide Openeye Name: 3-ethyl-N-[[(3S)-1-ethyl-3-piperidyl]methyl]-6-[(2-methoxyacetyl)amino]-N-methyl-2-(3-pyridyl)benzimidazole-4-carboxamide CAS Name: 3-ethyl-N-[[(3S)-1-ethyl-3-piperidinyl]methyl]-6-[(2-methoxy-1-oxoethyl)amino]-N-methyl-2-(3-pyridinyl)-4-benzimidazolecarboxamide IUPAC Name: 3-ethyl-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-6-[(2-methoxyacetyl)amino]-N-methyl-2-pyridin-3-ylbenzimidazole-4-carboxamide Traditional Name: 3-ethyl-N-[[(3S)-1-ethyl-3-piperidyl]methyl]-6-[(2-methoxyacetyl)amino]-N-methyl-2-(3-pyridyl)benzimidazole-4-carboxamide Formula: C27H36N6O3 MolecularWeight: 492.61314

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(C1)CN(C)C(=O)C2=CC(=CC3=C2N(C(=N3)C4=CN=CC=C4)CC)NC(=O)COC

Isomeric SMILES

CCN1CCC[C@@H](C1)CN(C)C(=O)C2=CC(=CC3=C2N(C(=N3)C4=CN=CC=C4)CC)NC(=O)COC

InChI

InChI=1S/C27H36N6O3/c1-5-32-12-8-9-19(17-32)16-31(3)27(35)22-13-21(29-24(34)18-36-4)14-23-25(22)33(6-2)26(30-23)20-10-7-11-28-15-20/h7,10-11,13-15,19H,5-6,8-9,12,16-18H2,1-4H3,(H,29,34)/t19-/m1/s1