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

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethyl-5-methylsulfonyl-4-pyridin-3-ylsulfanyl-benzamide Openeye Name: N-(diaminomethylene)-2-ethyl-5-methylsulfonyl-4-(3-pyridylsulfanyl)benzamide CAS Name: N-(diaminomethylidene)-2-ethyl-5-methylsulfonyl-4-(3-pyridinylthio)benzamide IUPAC Name: N-(diaminomethylidene)-2-ethyl-5-methylsulfonyl-4-pyridin-3-ylsulfanylbenzamide Traditional Name: N-(diaminomethylene)-2-ethyl-5-mesyl-4-(3-pyridylthio)benzamide Formula: C16H18N4O3S2 MolecularWeight: 378.46912

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)SC2=CN=CC=C2

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)SC2=CN=CC=C2

InChI

InChI=1S/C16H18N4O3S2/c1-3-10-7-13(24-11-5-4-6-19-9-11)14(25(2,22)23)8-12(10)15(21)20-16(17)18/h4-9H,3H2,1-2H3,(H4,17,18,20,21)