N-[bis(azanyl)methylidene]-3-methylsulfonyl-4-[(phenylmethyl)amino]benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-3-methylsulfonyl-4-[(phenylmethyl)amino]benzamide Openeye Name: 4-(benzylamino)-N-(diaminomethylene)-3-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-3-methylsulfonyl-4-[(phenylmethyl)amino]benzamide IUPAC Name: 4-(benzylamino)-N-(diaminomethylidene)-3-methylsulfonylbenzamide Traditional Name: 4-(benzylamino)-N-(diaminomethylene)-3-mesyl-benzamide Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N=C(N)N)NCC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N=C(N)N)NCC2=CC=CC=C2

InChI

InChI=1S/C16H18N4O3S/c1-24(22,23)14-9-12(15(21)20-16(17)18)7-8-13(14)19-10-11-5-3-2-4-6-11/h2-9,19H,10H2,1H3,(H4,17,18,20,21)