N-[[2-(2-azanyl-2-oxidanylidene-ethoxy)-4-carbamimidoyl-phenyl]methyl]-5-methyl-pyridine-3-carboxamide hydrochloride

Systemtic Name: N-[[2-(2-azanyl-2-oxidanylidene-ethoxy)-4-carbamimidoyl-phenyl]methyl]-5-methyl-pyridine-3-carboxamide hydrochloride Openeye Name: N-[[2-(2-amino-2-oxo-ethoxy)-4-carbamimidoyl-phenyl]methyl]-5-methyl-pyridine-3-carboxamide hydrochloride CAS Name: N-[[2-(2-amino-2-oxoethoxy)-4-carbamimidoylphenyl]methyl]-5-methyl-3-pyridinecarboxamide hydrochloride IUPAC Name: N-[[2-(2-amino-2-oxoethoxy)-4-carbamimidoylphenyl]methyl]-5-methylpyridine-3-carboxamide hydrochloride Traditional Name: N-[4-amidino-2-(2-amino-2-keto-ethoxy)benzyl]-5-methyl-nicotinamide hydrochloride Formula: C17H20ClN5O3 MolecularWeight: 377.8254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCC(=O)N.Cl

Isomeric SMILES

CC1=CN=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCC(=O)N.Cl

InChI

InChI=1S/C17H19N5O3.ClH/c1-10-4-13(7-21-6-10)17(24)22-8-12-3-2-11(16(19)20)5-14(12)25-9-15(18)23;/h2-7H,8-9H2,1H3,(H2,18,23)(H3,19,20)(H,22,24);1H