4-[[6-[(1-ethanimidoylpiperidin-4-yl)amino]benzimidazol-1-yl]methyl]naphthalene-1-carboximidamide

Systemtic Name: 4-[[6-[(1-ethanimidoylpiperidin-4-yl)amino]benzimidazol-1-yl]methyl]naphthalene-1-carboximidamide Openeye Name: 4-[[6-[(1-ethanimidoyl-4-piperidyl)amino]benzimidazol-1-yl]methyl]naphthalene-1-carboxamidine CAS Name: 4-[[6-[[1-(1-iminoethyl)-4-piperidinyl]amino]-1-benzimidazolyl]methyl]-1-naphthalenecarboximidamide IUPAC Name: 4-[[6-[(1-ethanimidoylpiperidin-4-yl)amino]benzimidazol-1-yl]methyl]naphthalene-1-carboximidamide Traditional Name: 4-[[6-[(1-acetimidoyl-4-piperidyl)amino]benzimidazol-1-yl]methyl]-1-naphthamidine Formula: C26H29N7 MolecularWeight: 439.55536

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)NC2=CC3=C(C=C2)N=CN3CC4=CC=C(C5=CC=CC=C45)C(=N)N

Isomeric SMILES

CC(=N)N1CCC(CC1)NC2=CC3=C(C=C2)N=CN3CC4=CC=C(C5=CC=CC=C45)C(=N)N

InChI

InChI=1S/C26H29N7/c1-17(27)32-12-10-19(11-13-32)31-20-7-9-24-25(14-20)33(16-30-24)15-18-6-8-23(26(28)29)22-5-3-2-4-21(18)22/h2-9,14,16,19,27,31H,10-13,15H2,1H3,(H3,28,29)