2-azanyl-5-[(4-azanyl-3-methyl-phenyl)carbamoylamino]benzenesulfonic acid

Systemtic Name: 2-azanyl-5-[(4-azanyl-3-methyl-phenyl)carbamoylamino]benzenesulfonic acid Openeye Name: 2-amino-5-[(4-amino-3-methyl-phenyl)carbamoylamino]benzenesulfonic acid CAS Name: 2-amino-5-[[(4-amino-3-methylanilino)-oxomethyl]amino]benzenesulfonic acid IUPAC Name: 2-amino-5-[(4-amino-3-methylphenyl)carbamoylamino]benzenesulfonic acid Traditional Name: 2-amino-5-[(4-amino-3-methyl-phenyl)carbamoylamino]besylic acid Formula: C14H16N4O4S MolecularWeight: 336.36624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N4O4S/c1-8-6-9(2-4-11(8)15)17-14(19)18-10-3-5-12(16)13(7-10)23(20,21)22/h2-7H,15-16H2,1H3,(H2,17,18,19)(H,20,21,22)