ethyl N-[6-[2-methyl-1-(oxan-4-ylmethyl)-6-oxidanylidene-pyridin-4-yl]-4-pyridin-2-yl-1H-benzimidazol-2-yl]carbamate

Systemtic Name: ethyl N-[6-[2-methyl-1-(oxan-4-ylmethyl)-6-oxidanylidene-pyridin-4-yl]-4-pyridin-2-yl-1H-benzimidazol-2-yl]carbamate Openeye Name: ethyl N-[6-[2-methyl-6-oxo-1-(tetrahydropyran-4-ylmethyl)-4-pyridyl]-4-(2-pyridyl)-1H-benzimidazol-2-yl]carbamate CAS Name: N-[6-[2-methyl-1-(4-oxanylmethyl)-6-oxo-4-pyridinyl]-4-(2-pyridinyl)-1H-benzimidazol-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[6-[2-methyl-1-(oxan-4-ylmethyl)-6-oxopyridin-4-yl]-4-pyridin-2-yl-1H-benzimidazol-2-yl]carbamate Traditional Name: N-[6-[2-keto-6-methyl-1-(tetrahydropyran-4-ylmethyl)-4-pyridyl]-4-(2-pyridyl)-1H-benzimidazol-2-yl]carbamic acid ethyl ester Formula: C27H29N5O4 MolecularWeight: 487.55026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CC(=O)N(C(=C3)C)CC4CCOCC4)C5=CC=CC=N5

Isomeric SMILES

CCOC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CC(=O)N(C(=C3)C)CC4CCOCC4)C5=CC=CC=N5

InChI

InChI=1S/C27H29N5O4/c1-3-36-27(34)31-26-29-23-14-20(13-21(25(23)30-26)22-6-4-5-9-28-22)19-12-17(2)32(24(33)15-19)16-18-7-10-35-11-8-18/h4-6,9,12-15,18H,3,7-8,10-11,16H2,1-2H3,(H2,29,30,31,34)