N-(5-cyclohexyl-1H-1,2,4-triazol-3-yl)-N'-[(4-methylphenyl)methyl]carbamimidate

Systemtic Name: N-(5-cyclohexyl-1H-1,2,4-triazol-3-yl)-N'-[(4-methylphenyl)methyl]carbamimidate Openeye Name: N-(5-cyclohexyl-1H-1,2,4-triazol-3-yl)-N'-(p-tolylmethyl)carbamimidate CAS Name: N-(5-cyclohexyl-1H-1,2,4-triazol-3-yl)-N'-[(4-methylphenyl)methyl]carbamimidate IUPAC Name: N-(5-cyclohexyl-1H-1,2,4-triazol-3-yl)-N'-[(4-methylphenyl)methyl]carbamimidate Traditional Name: N-(5-cyclohexyl-1H-1,2,4-triazol-3-yl)-N'-(4-methylbenzyl)carbamimidate Formula: C17H22N5O- MolecularWeight: 312.38948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN=C(NC2=NNC(=N2)C3CCCCC3)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN=C(NC2=NNC(=N2)C3CCCCC3)[O-]

InChI

InChI=1S/C17H23N5O/c1-12-7-9-13(10-8-12)11-18-17(23)20-16-19-15(21-22-16)14-5-3-2-4-6-14/h7-10,14H,2-6,11H2,1H3,(H3,18,19,20,21,22,23)/p-1