ethyl N-[2-[[(6-chloranylpyridin-3-yl)carbonylamino]methyl]-1-methyl-benzimidazol-5-yl]carbamate

Systemtic Name: ethyl N-[2-[[(6-chloranylpyridin-3-yl)carbonylamino]methyl]-1-methyl-benzimidazol-5-yl]carbamate Openeye Name: ethyl N-[2-[[(6-chloropyridine-3-carbonyl)amino]methyl]-1-methyl-benzimidazol-5-yl]carbamate CAS Name: N-[2-[[[(6-chloro-3-pyridinyl)-oxomethyl]amino]methyl]-1-methyl-5-benzimidazolyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[[(6-chloropyridine-3-carbonyl)amino]methyl]-1-methylbenzimidazol-5-yl]carbamate Traditional Name: N-[2-[[(6-chloronicotinoyl)amino]methyl]-1-methyl-benzimidazol-5-yl]carbamic acid ethyl ester Formula: C18H18ClN5O3 MolecularWeight: 387.82022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)N(C(=N2)CNC(=O)C3=CN=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)N(C(=N2)CNC(=O)C3=CN=C(C=C3)Cl)C

InChI

InChI=1S/C18H18ClN5O3/c1-3-27-18(26)22-12-5-6-14-13(8-12)23-16(24(14)2)10-21-17(25)11-4-7-15(19)20-9-11/h4-9H,3,10H2,1-2H3,(H,21,25)(H,22,26)