(Z)-3-methoxy-2-[3-methyl-2-(2-methylsulfanyl-1,3-thiazol-4-yl)-1-benzofuran-7-yl]prop-2-enoic acid

Systemtic Name: (Z)-3-methoxy-2-[3-methyl-2-(2-methylsulfanyl-1,3-thiazol-4-yl)-1-benzofuran-7-yl]prop-2-enoic acid Openeye Name: (Z)-3-methoxy-2-[3-methyl-2-(2-methylsulfanylthiazol-4-yl)benzofuran-7-yl]prop-2-enoic acid CAS Name: (Z)-3-methoxy-2-[3-methyl-2-[2-(methylthio)-4-thiazolyl]-7-benzofuranyl]-2-propenoic acid IUPAC Name: (Z)-3-methoxy-2-[3-methyl-2-(2-methylsulfanyl-1,3-thiazol-4-yl)-1-benzofuran-7-yl]prop-2-enoic acid Traditional Name: (Z)-3-methoxy-2-[3-methyl-2-[2-(methylthio)thiazol-4-yl]benzofuran-7-yl]acrylic acid Formula: C17H15NO4S2 MolecularWeight: 361.4353

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC=C2C(=COC)C(=O)O)C3=CSC(=N3)SC

Isomeric SMILES

CC1=C(OC2=C1C=CC=C2/C(=C/OC)/C(=O)O)C3=CSC(=N3)SC

InChI

InChI=1S/C17H15NO4S2/c1-9-10-5-4-6-11(12(7-21-2)16(19)20)15(10)22-14(9)13-8-24-17(18-13)23-3/h4-8H,1-3H3,(H,19,20)/b12-7-