(E)-2-cyano-N-propan-2-yl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-2-cyano-N-propan-2-yl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-2-cyano-N-isopropyl-3-(2-thienyl)-N-(2-thioxo-3H-1,3-benzothiazol-6-yl)prop-2-enamide CAS Name: (E)-2-cyano-N-propan-2-yl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-2-cyano-N-propan-2-yl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-2-cyano-N-isopropyl-3-(2-thienyl)-N-(2-thioxo-3H-1,3-benzothiazol-6-yl)acrylamide Formula: C18H15N3OS3 MolecularWeight: 385.5262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC2=C(C=C1)NC(=S)S2)C(=O)C(=CC3=CC=CS3)C#N

Isomeric SMILES

CC(C)N(C1=CC2=C(C=C1)NC(=S)S2)C(=O)/C(=C/C3=CC=CS3)/C#N

InChI

InChI=1S/C18H15N3OS3/c1-11(2)21(13-5-6-15-16(9-13)25-18(23)20-15)17(22)12(10-19)8-14-4-3-7-24-14/h3-9,11H,1-2H3,(H,20,23)/b12-8+