methyl 2-[2-[2-[[3-(2-ethoxyethyl)-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: methyl 2-[2-[2-[[3-(2-ethoxyethyl)-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: methyl 2-[[2-[2-[[3-(2-ethoxyethyl)-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-ethoxyethyl)-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 methyl ester IUPAC Name: methyl 2-[[2-[2-[[3-(2-ethoxyethyl)-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-ethoxyethyl)-6-fluoro-1,3-benzothiazol-2-ylidene]amino]-2-keto-ethyl]thio]acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C26H30FN3O5S3 MolecularWeight: 579.726903

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)F)SC1=NC(=O)CSCC(=O)NC3=C(C4=C(S3)CC(CC4)C)C(=O)OC

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)F)SC1=NC(=O)CSCC(=O)NC3=C(C4=C(S3)CC(CC4)C)C(=O)OC

InChI

InChI=1S/C26H30FN3O5S3/c1-4-35-10-9-30-18-8-6-16(27)12-20(18)38-26(30)29-22(32)14-36-13-21(31)28-24-23(25(33)34-3)17-7-5-15(2)11-19(17)37-24/h6,8,12,15H,4-5,7,9-11,13-14H2,1-3H3,(H,28,31)