N-[(3-carbamimidoylphenyl)methyl]-6-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxidanylidene-3H-benzimidazole-1-carboxamide

Systemtic Name: N-[(3-carbamimidoylphenyl)methyl]-6-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxidanylidene-3H-benzimidazole-1-carboxamide Openeye Name: N-[(3-carbamimidoylphenyl)methyl]-6-[(1-ethanimidoyl-4-piperidyl)oxy]-2-oxo-3H-benzimidazole-1-carboxamide CAS Name: N-[(3-carbamimidoylphenyl)methyl]-6-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-2-oxo-3H-benzimidazole-1-carboxamide IUPAC Name: N-[(3-carbamimidoylphenyl)methyl]-6-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxo-3H-benzimidazole-1-carboxamide Traditional Name: 6-[(1-acetimidoyl-4-piperidyl)oxy]-N-(3-amidinobenzyl)-2-keto-3H-benzimidazole-1-carboxamide Formula: C23H27N7O3 MolecularWeight: 449.50558

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)OC2=CC3=C(C=C2)NC(=O)N3C(=O)NCC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CC(=N)N1CCC(CC1)OC2=CC3=C(C=C2)NC(=O)N3C(=O)NCC4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C23H27N7O3/c1-14(24)29-9-7-17(8-10-29)33-18-5-6-19-20(12-18)30(23(32)28-19)22(31)27-13-15-3-2-4-16(11-15)21(25)26/h2-6,11-12,17,24H,7-10,13H2,1H3,(H3,25,26)(H,27,31)(H,28,32)