ethyl 2-[2-[2-[[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[2-[[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[2-[[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]amino]-2-oxo-ethyl]sulfanylacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[2-[[2-[[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]amino]-2-oxoethyl]thio]-1-oxoethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-[[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]amino]-2-oxoethyl]sulfanylacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[2-[[2-[[3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]amino]-2-keto-ethyl]thio]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester Formula: C25H29N3O5S3 MolecularWeight: 547.70986

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=CC=CC=C2SC1=NC(=O)CSCC(=O)NC3=C(C4=C(S3)CCC4)C(=O)OCC

Isomeric SMILES

CCOCCN1C2=CC=CC=C2SC1=NC(=O)CSCC(=O)NC3=C(C4=C(S3)CCC4)C(=O)OCC

InChI

InChI=1S/C25H29N3O5S3/c1-3-32-13-12-28-17-9-5-6-10-19(17)36-25(28)27-21(30)15-34-14-20(29)26-23-22(24(31)33-4-2)16-8-7-11-18(16)35-23/h5-6,9-10H,3-4,7-8,11-15H2,1-2H3,(H,26,29)