(4-methylsulfanylphenyl) 4-[bis(azanyl)methylideneamino]benzoate

Systemtic Name: (4-methylsulfanylphenyl) 4-[bis(azanyl)methylideneamino]benzoate Openeye Name: (4-methylsulfanylphenyl) 4-guanidinobenzoate CAS Name: 4-(diaminomethylideneamino)benzoic acid [4-(methylthio)phenyl] ester IUPAC Name: (4-methylsulfanylphenyl) 4-(diaminomethylideneamino)benzoate Traditional Name: 4-guanidinobenzoic acid [4-(methylthio)phenyl] ester Formula: C15H15N3O2S MolecularWeight: 301.3635

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N

Isomeric SMILES

CSC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N

InChI

InChI=1S/C15H15N3O2S/c1-21-13-8-6-12(7-9-13)20-14(19)10-2-4-11(5-3-10)18-15(16)17/h2-9H,1H3,(H4,16,17,18)