N-[bis(azanyl)methylidene]-1-(2-methylsulfonylphenyl)pyrrolo[2,3-b]pyridine-3-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-1-(2-methylsulfonylphenyl)pyrrolo[2,3-b]pyridine-3-carboxamide Openeye Name: N-(diaminomethylene)-1-(2-methylsulfonylphenyl)pyrrolo[2,3-b]pyridine-3-carboxamide CAS Name: N-(diaminomethylidene)-1-(2-methylsulfonylphenyl)-3-pyrrolo[2,3-b]pyridinecarboxamide IUPAC Name: N-(diaminomethylidene)-1-(2-methylsulfonylphenyl)pyrrolo[2,3-b]pyridine-3-carboxamide Traditional Name: N-(diaminomethylene)-1-(2-mesylphenyl)pyrrolo[2,3-b]pyridine-3-carboxamide Formula: C16H15N5O3S MolecularWeight: 357.387

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1N2C=C(C3=C2N=CC=C3)C(=O)N=C(N)N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1N2C=C(C3=C2N=CC=C3)C(=O)N=C(N)N

InChI

InChI=1S/C16H15N5O3S/c1-25(23,24)13-7-3-2-6-12(13)21-9-11(15(22)20-16(17)18)10-5-4-8-19-14(10)21/h2-9H,1H3,(H4,17,18,20,22)