S-phenyl 4-[bis(azanyl)methylideneamino]benzenecarbothioate; phosphoric acid

Systemtic Name: S-phenyl 4-[bis(azanyl)methylideneamino]benzenecarbothioate; phosphoric acid Openeye Name: S-phenyl 4-guanidinobenzenecarbothioate; phosphoric acid CAS Name: 4-(diaminomethylideneamino)benzenecarbothioic acid S-phenyl ester; phosphoric acid IUPAC Name: S-phenyl 4-(diaminomethylideneamino)benzenecarbothioate; phosphoric acid Traditional Name: 4-guanidinothiobenzoic acid S-phenyl ester; phosphoric acid Formula: C14H16N3O5PS MolecularWeight: 369.332701

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC(=O)C2=CC=C(C=C2)N=C(N)N.OP(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)SC(=O)C2=CC=C(C=C2)N=C(N)N.OP(=O)(O)O

InChI

InChI=1S/C14H13N3OS.H3O4P/c15-14(16)17-11-8-6-10(7-9-11)13(18)19-12-4-2-1-3-5-12;1-5(2,3)4/h1-9H,(H4,15,16,17);(H3,1,2,3,4)