2-methylpropyl 2-[3-[(7-carbamimidoylnaphthalen-2-yl)methyl]-5-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxidanylidene-benzimidazol-1-yl]ethanoate

Systemtic Name: 2-methylpropyl 2-[3-[(7-carbamimidoylnaphthalen-2-yl)methyl]-5-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxidanylidene-benzimidazol-1-yl]ethanoate Openeye Name: isobutyl 2-[3-[(7-carbamimidoyl-2-naphthyl)methyl]-5-[(1-ethanimidoyl-4-piperidyl)oxy]-2-oxo-benzimidazol-1-yl]acetate CAS Name: 2-[3-[(7-carbamimidoyl-2-naphthalenyl)methyl]-5-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-2-oxo-1-benzimidazolyl]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[3-[(7-carbamimidoylnaphthalen-2-yl)methyl]-5-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxobenzimidazol-1-yl]acetate Traditional Name: 2-[5-[(1-acetimidoyl-4-piperidyl)oxy]-3-[(7-amidino-2-naphthyl)methyl]-2-keto-benzimidazol-1-yl]acetic acid isobutyl ester Formula: C32H38N6O4 MolecularWeight: 570.68192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)CN1C2=C(C=C(C=C2)OC3CCN(CC3)C(=N)C)N(C1=O)CC4=CC5=C(C=C4)C=CC(=C5)C(=N)N

Isomeric SMILES

CC(C)COC(=O)CN1C2=C(C=C(C=C2)OC3CCN(CC3)C(=N)C)N(C1=O)CC4=CC5=C(C=C4)C=CC(=C5)C(=N)N

InChI

InChI=1S/C32H38N6O4/c1-20(2)19-41-30(39)18-38-28-9-8-27(42-26-10-12-36(13-11-26)21(3)33)16-29(28)37(32(38)40)17-22-4-5-23-6-7-24(31(34)35)15-25(23)14-22/h4-9,14-16,20,26,33H,10-13,17-19H2,1-3H3,(H3,34,35)