(E)-3-[2,6-bis(chloranyl)-4-[[4-[3-(2,2-dimethylpropoxymethyl)-2-methoxy-phenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methoxy-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-methoxy-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-methoxy-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-methoxy-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-methoxyprop-2-enoic acid Traditional Name: (E)-3-[2,6-dichloro-4-[[4-[2-methoxy-3-(neopentyloxymethyl)phenyl]thiazol-2-yl]carbamoyl]phenyl]-2-methoxy-acrylic acid Formula: C27H28Cl2N2O6S MolecularWeight: 579.49202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COCC1=CC=CC(=C1OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)Cl)C=C(C(=O)O)OC)Cl

Isomeric SMILES

CC(C)(C)COCC1=CC=CC(=C1OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)Cl)/C=C(\C(=O)O)/OC)Cl

InChI

InChI=1S/C27H28Cl2N2O6S/c1-27(2,3)14-37-12-15-7-6-8-17(23(15)36-5)21-13-38-26(30-21)31-24(32)16-9-19(28)18(20(29)10-16)11-22(35-4)25(33)34/h6-11,13H,12,14H2,1-5H3,(H,33,34)(H,30,31,32)/b22-11+