N-[bis(azanyl)methylidene]-4-cyclopentyl-2-ethynyl-5-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-cyclopentyl-2-ethynyl-5-methylsulfonyl-benzamide Openeye Name: 4-cyclopentyl-N-(diaminomethylene)-2-ethynyl-5-methylsulfonyl-benzamide CAS Name: 4-cyclopentyl-N-(diaminomethylidene)-2-ethynyl-5-methylsulfonylbenzamide IUPAC Name: 4-cyclopentyl-N-(diaminomethylidene)-2-ethynyl-5-methylsulfonylbenzamide Traditional Name: 4-cyclopentyl-N-(diaminomethylene)-2-ethynyl-5-mesyl-benzamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)N=C(N)N)C#C)C2CCCC2

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)N=C(N)N)C#C)C2CCCC2

InChI

InChI=1S/C16H19N3O3S/c1-3-10-8-12(11-6-4-5-7-11)14(23(2,21)22)9-13(10)15(20)19-16(17)18/h1,8-9,11H,4-7H2,2H3,(H4,17,18,19,20)