S-(phenylmethyl) 4-[bis(azanyl)methylideneamino]benzenecarbothioate

Systemtic Name: S-(phenylmethyl) 4-[bis(azanyl)methylideneamino]benzenecarbothioate Openeye Name: S-benzyl 4-guanidinobenzenecarbothioate CAS Name: 4-(diaminomethylideneamino)benzenecarbothioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl 4-(diaminomethylideneamino)benzenecarbothioate Traditional Name: 4-guanidinothiobenzoic acid S-benzyl ester Formula: C15H15N3OS MolecularWeight: 285.3641

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC(=O)C2=CC=C(C=C2)N=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)CSC(=O)C2=CC=C(C=C2)N=C(N)N

InChI

InChI=1S/C15H15N3OS/c16-15(17)18-13-8-6-12(7-9-13)14(19)20-10-11-4-2-1-3-5-11/h1-9H,10H2,(H4,16,17,18)