methyl 2-[[2-[(2E)-2-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methylidene]hydrazinyl]-2-oxidanylidene-ethanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-[[2-[(2E)-2-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methylidene]hydrazinyl]-2-oxidanylidene-ethanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[(2E)-2-[(4-benzyloxy-3-bromo-5-ethoxy-phenyl)methylene]hydrazino]-2-oxo-acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[2-[(2E)-2-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylidene]hydrazinyl]-1,2-dioxoethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[(2E)-2-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylidene]hydrazinyl]-2-oxoacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[2-[(N'E)-N'-(4-benzoxy-3-bromo-5-ethoxy-benzylidene)hydrazino]-2-keto-acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C27H26BrN3O6S MolecularWeight: 600.48084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=O)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC)Br)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=N/NC(=O)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C27H26BrN3O6S/c1-3-36-20-13-17(12-19(28)23(20)37-15-16-8-5-4-6-9-16)14-29-31-25(33)24(32)30-26-22(27(34)35-2)18-10-7-11-21(18)38-26/h4-6,8-9,12-14H,3,7,10-11,15H2,1-2H3,(H,30,32)(H,31,33)/b29-14+