N-[bis(azanyl)methylidene]-2-ethyl-5-methylsulfonyl-4-pyridin-3-yl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethyl-5-methylsulfonyl-4-pyridin-3-yl-benzamide Openeye Name: N-(diaminomethylene)-2-ethyl-5-methylsulfonyl-4-(3-pyridyl)benzamide CAS Name: N-(diaminomethylidene)-2-ethyl-5-methylsulfonyl-4-(3-pyridinyl)benzamide IUPAC Name: N-(diaminomethylidene)-2-ethyl-5-methylsulfonyl-4-pyridin-3-ylbenzamide Traditional Name: N-(diaminomethylene)-2-ethyl-5-mesyl-4-(3-pyridyl)benzamide Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C2=CN=CC=C2)S(=O)(=O)C)C(=O)N=C(N)N

Isomeric SMILES

CCC1=C(C=C(C(=C1)C2=CN=CC=C2)S(=O)(=O)C)C(=O)N=C(N)N

InChI

InChI=1S/C16H18N4O3S/c1-3-10-7-12(11-5-4-6-19-9-11)14(24(2,22)23)8-13(10)15(21)20-16(17)18/h4-9H,3H2,1-2H3,(H4,17,18,20,21)