N-[bis(azanyl)methylidene]-2-ethyl-5-methylsulfonyl-4-propan-2-ylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethyl-5-methylsulfonyl-4-propan-2-ylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-2-ethyl-4-isopropylsulfonyl-5-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-2-ethyl-5-methylsulfonyl-4-propan-2-ylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-2-ethyl-5-methylsulfonyl-4-propan-2-ylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-2-ethyl-4-isopropylsulfonyl-5-mesyl-benzamide Formula: C14H21N3O5S2 MolecularWeight: 375.46364

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)S(=O)(=O)C(C)C

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)S(=O)(=O)C(C)C

InChI

InChI=1S/C14H21N3O5S2/c1-5-9-6-12(24(21,22)8(2)3)11(23(4,19)20)7-10(9)13(18)17-14(15)16/h6-8H,5H2,1-4H3,(H4,15,16,17,18)