ethyl 2-[[5-[(3-ethoxycarbonyl-1-benzothiophen-2-yl)amino]-5-oxidanylidene-pentanoyl]amino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[5-[(3-ethoxycarbonyl-1-benzothiophen-2-yl)amino]-5-oxidanylidene-pentanoyl]amino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[5-[(3-ethoxycarbonylbenzothiophen-2-yl)amino]-5-oxo-pentanoyl]amino]benzothiophene-3-carboxylate CAS Name: 2-[[5-[(3-ethoxycarbonyl-1-benzothiophen-2-yl)amino]-1,5-dioxopentyl]amino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-[(3-ethoxycarbonyl-1-benzothiophen-2-yl)amino]-5-oxopentanoyl]amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[[5-[(3-carbethoxybenzothiophen-2-yl)amino]-5-keto-pentanoyl]amino]benzothiophene-3-carboxylic acid ethyl ester Formula: C27H26N2O6S2 MolecularWeight: 538.63514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)CCCC(=O)NC3=C(C4=CC=CC=C4S3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)CCCC(=O)NC3=C(C4=CC=CC=C4S3)C(=O)OCC

InChI

InChI=1S/C27H26N2O6S2/c1-3-34-26(32)22-16-10-5-7-12-18(16)36-24(22)28-20(30)14-9-15-21(31)29-25-23(27(33)35-4-2)17-11-6-8-13-19(17)37-25/h5-8,10-13H,3-4,9,14-15H2,1-2H3,(H,28,30)(H,29,31)