bis(azanyl)methylidene-(2-methyl-5-methylsulfonyl-phenyl)carbonyl-[(4-methylphenyl)amino]azanium

Systemtic Name: bis(azanyl)methylidene-(2-methyl-5-methylsulfonyl-phenyl)carbonyl-[(4-methylphenyl)amino]azanium Openeye Name: diaminomethylene-(4-methylanilino)-(2-methyl-5-methylsulfonyl-benzoyl)ammonium CAS Name: diaminomethylidene-(4-methylanilino)-[(2-methyl-5-methylsulfonylphenyl)-oxomethyl]ammonium IUPAC Name: diaminomethylidene-(4-methylanilino)-(2-methyl-5-methylsulfonylbenzoyl)azanium Traditional Name: diaminomethylene-(5-mesyl-2-methyl-benzoyl)-(p-toluidino)ammonium Formula: C17H21N4O3S+ MolecularWeight: 361.43864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N[N+](=C(N)N)C(=O)C2=C(C=CC(=C2)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N[N+](=C(N)N)C(=O)C2=C(C=CC(=C2)S(=O)(=O)C)C

InChI

InChI=1S/C17H20N4O3S/c1-11-4-7-13(8-5-11)20-21(17(18)19)16(22)15-10-14(25(3,23)24)9-6-12(15)2/h4-10,20H,1-3H3,(H3,18,19)/p+1