2-[2-[(3-ethoxycarbonyl-4-methyl-5-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[(3-ethoxycarbonyl-4-methyl-5-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-[(3-ethoxycarbonyl-4-methyl-5-phenyl-2-thienyl)amino]-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-[(3-ethoxycarbonyl-4-methyl-5-phenyl-2-thiophenyl)amino]-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-[(3-ethoxycarbonyl-4-methyl-5-phenylthiophen-2-yl)amino]-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-[(3-carbethoxy-4-methyl-5-phenyl-2-thienyl)amino]-2-keto-ethyl]thio]acetic acid Formula: C18H19NO5S2 MolecularWeight: 393.47716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C2=CC=CC=C2)NC(=O)CSCC(=O)O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C2=CC=CC=C2)NC(=O)CSCC(=O)O

InChI

InChI=1S/C18H19NO5S2/c1-3-24-18(23)15-11(2)16(12-7-5-4-6-8-12)26-17(15)19-13(20)9-25-10-14(21)22/h4-8H,3,9-10H2,1-2H3,(H,19,20)(H,21,22)