2-[[2-[(4-ethoxycarbonyl-1,3-thiazol-2-yl)amino]-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]sulfanylmethyl]-5-methoxy-6-methyl-3-oxidanyl-benzoic acid

Systemtic Name: 2-[[2-[(4-ethoxycarbonyl-1,3-thiazol-2-yl)amino]-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]sulfanylmethyl]-5-methoxy-6-methyl-3-oxidanyl-benzoic acid Openeye Name: 2-[[2-[(4-ethoxycarbonylthiazol-2-yl)amino]-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]sulfanylmethyl]-3-hydroxy-5-methoxy-6-methyl-benzoic acid CAS Name: 2-[[[2-[(4-ethoxycarbonyl-2-thiazolyl)amino]-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]thio]methyl]-3-hydroxy-5-methoxy-6-methylbenzoic acid IUPAC Name: 2-[[2-[(4-ethoxycarbonyl-1,3-thiazol-2-yl)amino]-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]sulfanylmethyl]-3-hydroxy-5-methoxy-6-methylbenzoic acid Traditional Name: 2-[[[2-[(4-carbethoxythiazol-2-yl)amino]-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]thio]methyl]-3-hydroxy-5-methoxy-6-methyl-benzoic acid Formula: C21H24N4O7S2 MolecularWeight: 508.56786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)NC(CSCC2=C(C=C(C(=C2C(=O)O)C)OC)O)C3=NC(=NO3)C

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)NC(CSCC2=C(C=C(C(=C2C(=O)O)C)OC)O)C3=NC(=NO3)C

InChI

InChI=1S/C21H24N4O7S2/c1-5-31-20(29)14-9-34-21(24-14)23-13(18-22-11(3)25-32-18)8-33-7-12-15(26)6-16(30-4)10(2)17(12)19(27)28/h6,9,13,26H,5,7-8H2,1-4H3,(H,23,24)(H,27,28)