[3-[bis(azanyl)methylidenecarbamothioylamino]phenyl] ethanoate

Systemtic Name: [3-[bis(azanyl)methylidenecarbamothioylamino]phenyl] ethanoate Openeye Name: [3-(diaminomethylenecarbamothioylamino)phenyl] acetate CAS Name: acetic acid [3-[[(diaminomethylideneamino)-sulfanylidenemethyl]amino]phenyl] ester IUPAC Name: [3-(diaminomethylidenecarbamothioylamino)phenyl] acetate Traditional Name: acetic acid [3-(diaminomethylenethiocarbamoylamino)phenyl] ester Formula: C10H12N4O2S MolecularWeight: 252.29288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC(=C1)NC(=S)N=C(N)N

Isomeric SMILES

CC(=O)OC1=CC=CC(=C1)NC(=S)N=C(N)N

InChI

InChI=1S/C10H12N4O2S/c1-6(15)16-8-4-2-3-7(5-8)13-10(17)14-9(11)12/h2-5H,1H3,(H5,11,12,13,14,17)