N-[bis(azanyl)methylidene]-2-ethyl-4-[(E)-2-methylbut-1-enyl]-5-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethyl-4-[(E)-2-methylbut-1-enyl]-5-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-2-ethyl-4-[(E)-2-methylbut-1-enyl]-5-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-2-ethyl-4-[(E)-2-methylbut-1-enyl]-5-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-2-ethyl-4-[(E)-2-methylbut-1-enyl]-5-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-2-ethyl-5-mesyl-4-[(E)-2-methylbut-1-enyl]benzamide Formula: C16H23N3O3S MolecularWeight: 337.43712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC1=C(C=C(C(=C1)/C=C(\C)/CC)S(=O)(=O)C)C(=O)N=C(N)N

InChI

InChI=1S/C16H23N3O3S/c1-5-10(3)7-12-8-11(6-2)13(15(20)19-16(17)18)9-14(12)23(4,21)22/h7-9H,5-6H2,1-4H3,(H4,17,18,19,20)/b10-7+