5-[[3-ethoxycarbonyl-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophen-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[3-ethoxycarbonyl-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophen-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[[3-ethoxycarbonyl-4-methyl-5-(o-tolylcarbamoyl)-2-thienyl]amino]-5-oxo-pentanoic acid CAS Name: 5-[[3-ethoxycarbonyl-4-methyl-5-[(2-methylanilino)-oxomethyl]-2-thiophenyl]amino]-5-oxopentanoic acid IUPAC Name: 5-[[3-ethoxycarbonyl-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophen-2-yl]amino]-5-oxopentanoic acid Traditional Name: 5-[[3-carbethoxy-4-methyl-5-(o-tolylcarbamoyl)-2-thienyl]amino]-5-keto-valeric acid Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2C)NC(=O)CCCC(=O)O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2C)NC(=O)CCCC(=O)O

InChI

InChI=1S/C21H24N2O6S/c1-4-29-21(28)17-13(3)18(19(27)22-14-9-6-5-8-12(14)2)30-20(17)23-15(24)10-7-11-16(25)26/h5-6,8-9H,4,7,10-11H2,1-3H3,(H,22,27)(H,23,24)(H,25,26)