ethyl 2-[2-[2-[[3-(2-ethoxy-2-oxidanylidene-ethyl)-6-fluoranyl-1,3-benzothiazol-2-ylidene]amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[2-[[3-(2-ethoxy-2-oxidanylidene-ethyl)-6-fluoranyl-1,3-benzothiazol-2-ylidene]amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[2-[[3-(2-ethoxy-2-oxo-ethyl)-6-fluoro-1,3-benzothiazol-2-ylidene]amino]-2-oxo-ethyl]sulfanylacetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-[[2-[[3-(2-ethoxy-2-oxoethyl)-6-fluoro-1,3-benzothiazol-2-ylidene]amino]-2-oxoethyl]thio]-1-oxoethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-[[3-(2-ethoxy-2-oxoethyl)-6-fluoro-1,3-benzothiazol-2-ylidene]amino]-2-oxoethyl]sulfanylacetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-[[2-[[3-(2-ethoxy-2-keto-ethyl)-6-fluoro-1,3-benzothiazol-2-ylidene]amino]-2-keto-ethyl]thio]acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C27H30FN3O6S3 MolecularWeight: 607.737003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)F)SC1=NC(=O)CSCC(=O)NC3=C(C4=C(S3)CC(CC4)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)F)SC1=NC(=O)CSCC(=O)NC3=C(C4=C(S3)CC(CC4)C)C(=O)OCC

InChI

InChI=1S/C27H30FN3O6S3/c1-4-36-23(34)12-31-18-9-7-16(28)11-20(18)40-27(31)30-22(33)14-38-13-21(32)29-25-24(26(35)37-5-2)17-8-6-15(3)10-19(17)39-25/h7,9,11,15H,4-6,8,10,12-14H2,1-3H3,(H,29,32)