methyl (NE)-N'-azanyl-N-[(4-chlorophenyl)methylidene]carbamimidothioate

Systemtic Name: methyl (NE)-N'-azanyl-N-[(4-chlorophenyl)methylidene]carbamimidothioate Openeye Name: (1E)-3-amino-1-[(4-chlorophenyl)methylene]-2-methyl-isothiourea CAS Name: (NE)-N'-amino-N-[(4-chlorophenyl)methylidene]carbamimidothioic acid methyl ester IUPAC Name: methyl (NE)-N'-amino-N-[(4-chlorophenyl)methylidene]carbamimidothioate Traditional Name: (1E)-3-amino-1-(4-chlorobenzylidene)-2-methyl-isothiourea Formula: C9H10ClN3S MolecularWeight: 227.7138

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NN)N=CC1=CC=C(C=C1)Cl

Isomeric SMILES

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

InChI

InChI=1S/C9H10ClN3S/c1-14-9(13-11)12-6-7-2-4-8(10)5-3-7/h2-6H,11H2,1H3/b12-6+,13-9-