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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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