methyl N'-[(E)-1-(3-chlorophenyl)ethylideneamino]carbamimidothioate

Systemtic Name: methyl N'-[(E)-1-(3-chlorophenyl)ethylideneamino]carbamimidothioate Openeye Name: 3-[(E)-1-(3-chlorophenyl)ethylideneamino]-2-methyl-isothiourea CAS Name: N'-[(E)-1-(3-chlorophenyl)ethylideneamino]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[(E)-1-(3-chlorophenyl)ethylideneamino]carbamimidothioate Traditional Name: 3-[(E)-1-(3-chlorophenyl)ethylideneamino]-2-methyl-isothiourea Formula: C10H12ClN3S MolecularWeight: 241.74038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN=C(N)SC)C1=CC(=CC=C1)Cl

Isomeric SMILES

C/C(=N\N=C(\N)/SC)/C1=CC(=CC=C1)Cl

InChI

InChI=1S/C10H12ClN3S/c1-7(13-14-10(12)15-2)8-4-3-5-9(11)6-8/h3-6H,1-2H3,(H2,12,14)/b13-7+