ethyl 2-cyano-3-(furan-2-yl)-3-(2-sulfanylidene-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)propanoate

Systemtic Name: ethyl 2-cyano-3-(furan-2-yl)-3-(2-sulfanylidene-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)propanoate Openeye Name: ethyl 2-cyano-3-(2-furyl)-3-(2-thioxo-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)propanoate CAS Name: 2-cyano-3-(2-furanyl)-3-(2-sulfanylidene-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)propanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-(furan-2-yl)-3-(2-sulfanylidene-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)propanoate Traditional Name: 2-cyano-3-(2-furyl)-3-(2-thioxo-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)propionic acid ethyl ester Formula: C17H18N2O3S2 MolecularWeight: 362.46642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(C1=CC=CO1)N2C3=C(CCCC3)SC2=S

Isomeric SMILES

CCOC(=O)C(C#N)C(C1=CC=CO1)N2C3=C(CCCC3)SC2=S

InChI

InChI=1S/C17H18N2O3S2/c1-2-21-16(20)11(10-18)15(13-7-5-9-22-13)19-12-6-3-4-8-14(12)24-17(19)23/h5,7,9,11,15H,2-4,6,8H2,1H3