(E)-3-[2,6-bis(chloranyl)-4-[[4-[3-(2,2-dimethylpropoxymethyl)-2-methoxy-phenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methyl-prop-2-enoic acid

Systemtic Name: (E)-3-[2,6-bis(chloranyl)-4-[[4-[3-(2,2-dimethylpropoxymethyl)-2-methoxy-phenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methyl-prop-2-enoic acid Openeye Name: (E)-3-[2,6-dichloro-4-[[4-[3-(2,2-dimethylpropoxymethyl)-2-methoxy-phenyl]thiazol-2-yl]carbamoyl]phenyl]-2-methyl-prop-2-enoic acid CAS Name: (E)-3-[2,6-dichloro-4-[[[4-[3-(2,2-dimethylpropoxymethyl)-2-methoxyphenyl]-2-thiazolyl]amino]-oxomethyl]phenyl]-2-methyl-2-propenoic acid IUPAC Name: (E)-3-[2,6-dichloro-4-[[4-[3-(2,2-dimethylpropoxymethyl)-2-methoxyphenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methylprop-2-enoic acid Traditional Name: (E)-3-[2,6-dichloro-4-[[4-[2-methoxy-3-(neopentyloxymethyl)phenyl]thiazol-2-yl]carbamoyl]phenyl]-2-methyl-acrylic acid Formula: C27H28Cl2N2O5S MolecularWeight: 563.49262

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=C(C=C(C=C1Cl)C(=O)NC2=NC(=CS2)C3=C(C(=CC=C3)COCC(C)(C)C)OC)Cl)C(=O)O

Isomeric SMILES

C/C(=C\C1=C(C=C(C=C1Cl)C(=O)NC2=NC(=CS2)C3=C(C(=CC=C3)COCC(C)(C)C)OC)Cl)/C(=O)O

InChI

InChI=1S/C27H28Cl2N2O5S/c1-15(25(33)34)9-19-20(28)10-17(11-21(19)29)24(32)31-26-30-22(13-37-26)18-8-6-7-16(23(18)35-5)12-36-14-27(2,3)4/h6-11,13H,12,14H2,1-5H3,(H,33,34)(H,30,31,32)/b15-9+