[azanyl-[2-[(4-carboxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-methylidene]azanium

Systemtic Name: [azanyl-[2-[(4-carboxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-methylidene]azanium Openeye Name: [amino-[2-(4-carboxyanilino)-2-oxo-ethyl]sulfanyl-methylene]ammonium CAS Name: [amino-[[2-(4-carboxyanilino)-2-oxoethyl]thio]methylidene]ammonium IUPAC Name: [amino-[2-(4-carboxyanilino)-2-oxoethyl]sulfanylmethylidene]azanium Traditional Name: [amino-[[2-(4-carboxyanilino)-2-keto-ethyl]thio]methylene]ammonium Formula: C10H12N3O3S+ MolecularWeight: 254.28558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)CSC(=[NH2+])N

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)CSC(=[NH2+])N

InChI

InChI=1S/C10H11N3O3S/c11-10(12)17-5-8(14)13-7-3-1-6(2-4-7)9(15)16/h1-4H,5H2,(H3,11,12)(H,13,14)(H,15,16)/p+1