N-[bis(azanyl)methylidene]-2-ethyl-5-methylsulfonyl-4-prop-2-ynyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethyl-5-methylsulfonyl-4-prop-2-ynyl-benzamide Openeye Name: N-(diaminomethylene)-2-ethyl-5-methylsulfonyl-4-prop-2-ynyl-benzamide CAS Name: N-(diaminomethylidene)-2-ethyl-5-methylsulfonyl-4-prop-2-ynylbenzamide IUPAC Name: N-(diaminomethylidene)-2-ethyl-5-methylsulfonyl-4-prop-2-ynylbenzamide Traditional Name: N-(diaminomethylene)-2-ethyl-5-mesyl-4-propargyl-benzamide Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O3S/c1-4-6-10-7-9(5-2)11(13(18)17-14(15)16)8-12(10)21(3,19)20/h1,7-8H,5-6H2,2-3H3,(H4,15,16,17,18)