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4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxidanylidene-2-(4-propan-2-yloxyphenyl)butanoic acid

4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxidanylidene-2-(4-propan-2-yloxyphenyl)butanoic acid

Systemtic Name:4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxidanylidene-2-(4-propan-2-yloxyphenyl)butanoic acid
Openeye Name:4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-(4-isopropoxyphenyl)-4-oxo-butanoic acid
CAS Name:4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxo-2-(4-propan-2-yloxyphenyl)butanoic acid
IUPAC Name:4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxo-2-(4-propan-2-yloxyphenyl)butanoic acid
Traditional Name:4-[(3-carbethoxy-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-(4-isopropoxyphenyl)-4-keto-butyric acid
Formula: C24H29NO6S
MolecularWeight: 459.55516
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CC(C3=CC=C(C=C3)OC(C)C)C(=O)O


Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CC(C3=CC=C(C=C3)OC(C)C)C(=O)O


InChI

InChI=1S/C24H29NO6S/c1-4-30-24(29)21-17-7-5-6-8-19(17)32-22(21)25-20(26)13-18(23(27)28)15-9-11-16(12-10-15)31-14(2)3/h9-12,14,18H,4-8,13H2,1-3H3,(H,25,26)(H,27,28)


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