N'-(4-butylphenyl)-4-(3-methylpyridin-2-yl)-N-oxidanyl-piperazine-1-carboximidamide

Systemtic Name: N'-(4-butylphenyl)-4-(3-methylpyridin-2-yl)-N-oxidanyl-piperazine-1-carboximidamide Openeye Name: N'-(4-butylphenyl)-N-hydroxy-4-(3-methyl-2-pyridyl)piperazine-1-carboxamidine CAS Name: N'-(4-butylphenyl)-N-hydroxy-4-(3-methyl-2-pyridinyl)-1-piperazinecarboximidamide IUPAC Name: N'-(4-butylphenyl)-N-hydroxy-4-(3-methylpyridin-2-yl)piperazine-1-carboximidamide Traditional Name: N'-(4-butylphenyl)-N-hydroxy-4-(3-methyl-2-pyridyl)piperazine-1-carboxamidine Formula: C21H29N5O MolecularWeight: 367.48786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N=C(NO)N2CCN(CC2)C3=C(C=CC=N3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N=C(NO)N2CCN(CC2)C3=C(C=CC=N3)C

InChI

InChI=1S/C21H29N5O/c1-3-4-7-18-8-10-19(11-9-18)23-21(24-27)26-15-13-25(14-16-26)20-17(2)6-5-12-22-20/h5-6,8-12,27H,3-4,7,13-16H2,1-2H3,(H,23,24)