2-azanyl-3-methanethioyl-4-[(4-methylphenyl)amino]benzenesulfonic acid

Systemtic Name: 2-azanyl-3-methanethioyl-4-[(4-methylphenyl)amino]benzenesulfonic acid Openeye Name: 2-amino-3-methanethioyl-4-(4-methylanilino)benzenesulfonic acid CAS Name: 2-amino-3-methanethioyl-4-(4-methylanilino)benzenesulfonic acid IUPAC Name: 2-amino-3-methanethioyl-4-(4-methylanilino)benzenesulfonic acid Traditional Name: 2-amino-4-(p-toluidino)-3-thioformyl-besylic acid Formula: C14H14N2O3S2 MolecularWeight: 322.40256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C(=C(C=C2)S(=O)(=O)O)N)C=S

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C(=C(C=C2)S(=O)(=O)O)N)C=S

InChI

InChI=1S/C14H14N2O3S2/c1-9-2-4-10(5-3-9)16-12-6-7-13(21(17,18)19)14(15)11(12)8-20/h2-8,16H,15H2,1H3,(H,17,18,19)