N-[bis(azanyl)methylidene]-2-ethyl-3-methylsulfonyl-4-(3-oxidanylpiperidin-1-yl)benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethyl-3-methylsulfonyl-4-(3-oxidanylpiperidin-1-yl)benzamide Openeye Name: N-(diaminomethylene)-2-ethyl-4-(3-hydroxy-1-piperidyl)-3-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-2-ethyl-4-(3-hydroxy-1-piperidinyl)-3-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-2-ethyl-4-(3-hydroxypiperidin-1-yl)-3-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-2-ethyl-4-(3-hydroxypiperidino)-3-mesyl-benzamide Formula: C16H24N4O4S MolecularWeight: 368.45116

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1S(=O)(=O)C)N2CCCC(C2)O)C(=O)N=C(N)N

Isomeric SMILES

CCC1=C(C=CC(=C1S(=O)(=O)C)N2CCCC(C2)O)C(=O)N=C(N)N

InChI

InChI=1S/C16H24N4O4S/c1-3-11-12(15(22)19-16(17)18)6-7-13(14(11)25(2,23)24)20-8-4-5-10(21)9-20/h6-7,10,21H,3-5,8-9H2,1-2H3,(H4,17,18,19,22)