ethyl N-[2-[2-[[(4-carbamimidoylphenyl)amino]methyl]-1-methyl-benzimidazol-5-yl]-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]-N-methyl-carbamate

Systemtic Name: ethyl N-[2-[2-[[(4-carbamimidoylphenyl)amino]methyl]-1-methyl-benzimidazol-5-yl]-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]-N-methyl-carbamate Openeye Name: ethyl N-[1-[2-[(4-carbamimidoylanilino)methyl]-1-methyl-benzimidazol-5-yl]-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl]-N-methyl-carbamate CAS Name: N-[2-[2-[(4-carbamimidoylanilino)methyl]-1-methyl-5-benzimidazolyl]-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]-N-methylcarbamic acid ethyl ester IUPAC Name: ethyl N-[2-[2-[(4-carbamimidoylanilino)methyl]-1-methylbenzimidazol-5-yl]-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-N-methylcarbamate Traditional Name: N-[1-[2-[(4-amidinoanilino)methyl]-1-methyl-benzimidazol-5-yl]-2-keto-1-methyl-2-pyrrolidino-ethyl]-N-methyl-carbamic acid ethyl ester Formula: C27H35N7O3 MolecularWeight: 505.6119

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(C)C(C)(C1=CC2=C(C=C1)N(C(=N2)CNC3=CC=C(C=C3)C(=N)N)C)C(=O)N4CCCC4

Isomeric SMILES

CCOC(=O)N(C)C(C)(C1=CC2=C(C=C1)N(C(=N2)CNC3=CC=C(C=C3)C(=N)N)C)C(=O)N4CCCC4

InChI

InChI=1S/C27H35N7O3/c1-5-37-26(36)33(4)27(2,25(35)34-14-6-7-15-34)19-10-13-22-21(16-19)31-23(32(22)3)17-30-20-11-8-18(9-12-20)24(28)29/h8-13,16,30H,5-7,14-15,17H2,1-4H3,(H3,28,29)