[4-[(2-methylphenyl)carbamothioylamino]phenyl] thiocyanate

Systemtic Name: [4-[(2-methylphenyl)carbamothioylamino]phenyl] thiocyanate Openeye Name: [4-(o-tolylcarbamothioylamino)phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[(2-methylanilino)-sulfanylidenemethyl]amino]phenyl] ester IUPAC Name: [4-[(2-methylphenyl)carbamothioylamino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-(o-tolylthiocarbamoylamino)phenyl] ester Formula: C15H13N3S2 MolecularWeight: 299.41382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NC2=CC=C(C=C2)SC#N

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NC2=CC=C(C=C2)SC#N

InChI

InChI=1S/C15H13N3S2/c1-11-4-2-3-5-14(11)18-15(19)17-12-6-8-13(9-7-12)20-10-16/h2-9H,1H3,(H2,17,18,19)