(E)-2-cyano-5-methyl-N-propan-2-yl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)hex-2-enamide

Systemtic Name: (E)-2-cyano-5-methyl-N-propan-2-yl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)hex-2-enamide Openeye Name: (E)-2-cyano-N-isopropyl-5-methyl-N-(2-thioxo-3H-1,3-benzothiazol-6-yl)hex-2-enamide CAS Name: (E)-2-cyano-5-methyl-N-propan-2-yl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)-2-hexenamide IUPAC Name: (E)-2-cyano-5-methyl-N-propan-2-yl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)hex-2-enamide Traditional Name: (E)-2-cyano-N-isopropyl-5-methyl-N-(2-thioxo-3H-1,3-benzothiazol-6-yl)hex-2-enamide Formula: C18H21N3OS2 MolecularWeight: 359.50884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC=C(C#N)C(=O)N(C1=CC2=C(C=C1)NC(=S)S2)C(C)C

Isomeric SMILES

CC(C)C/C=C(\C#N)/C(=O)N(C1=CC2=C(C=C1)NC(=S)S2)C(C)C

InChI

InChI=1S/C18H21N3OS2/c1-11(2)5-6-13(10-19)17(22)21(12(3)4)14-7-8-15-16(9-14)24-18(23)20-15/h6-9,11-12H,5H2,1-4H3,(H,20,23)/b13-6+