methyl (E)-2-(2-acetamido-1,3-thiazol-4-yl)-3-(thian-4-yl)prop-2-enoate

Systemtic Name: methyl (E)-2-(2-acetamido-1,3-thiazol-4-yl)-3-(thian-4-yl)prop-2-enoate Openeye Name: methyl (E)-2-(2-acetamidothiazol-4-yl)-3-tetrahydrothiopyran-4-yl-prop-2-enoate CAS Name: (E)-2-(2-acetamido-4-thiazolyl)-3-(4-thianyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-(2-acetamido-1,3-thiazol-4-yl)-3-(thian-4-yl)prop-2-enoate Traditional Name: (E)-2-(2-acetamidothiazol-4-yl)-3-tetrahydrothiopyran-4-yl-acrylic acid methyl ester Formula: C14H18N2O3S2 MolecularWeight: 326.43432

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)C(=CC2CCSCC2)C(=O)OC

Isomeric SMILES

CC(=O)NC1=NC(=CS1)/C(=C\C2CCSCC2)/C(=O)OC

InChI

InChI=1S/C14H18N2O3S2/c1-9(17)15-14-16-12(8-21-14)11(13(18)19-2)7-10-3-5-20-6-4-10/h7-8,10H,3-6H2,1-2H3,(H,15,16,17)/b11-7+