4-[(4-chlorophenyl)carbonylamino]-N-(1H-1,2,4-triazol-5-yl)butanimidate

Systemtic Name: 4-[(4-chlorophenyl)carbonylamino]-N-(1H-1,2,4-triazol-5-yl)butanimidate Openeye Name: 4-[(4-chlorobenzoyl)amino]-N-(1H-1,2,4-triazol-5-yl)butanimidate CAS Name: 4-[[(4-chlorophenyl)-oxomethyl]amino]-N-(1H-1,2,4-triazol-5-yl)butanimidate IUPAC Name: 4-[(4-chlorobenzoyl)amino]-N-(1H-1,2,4-triazol-5-yl)butanimidate Traditional Name: 4-[(4-chlorobenzoyl)amino]-N-(1H-1,2,4-triazol-5-yl)butyrimidate Formula: C13H13ClN5O2- MolecularWeight: 306.72762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCCC(=NC2=NC=NN2)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCCC(=NC2=NC=NN2)[O-])Cl

InChI

InChI=1S/C13H14ClN5O2/c14-10-5-3-9(4-6-10)12(21)15-7-1-2-11(20)18-13-16-8-17-19-13/h3-6,8H,1-2,7H2,(H,15,21)(H2,16,17,18,19,20)/p-1