(E)-3-[2,6-bis(chloranyl)-4-[[4-[3-(2-hexoxyethyl)-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-hexoxyethyl)-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-hexoxyethyl)-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-hexoxyethyl)-2-methoxyphenyl]-2-thiazolyl]amino]-oxomethyl]phenyl]-2-methyl-2-propenoic acid IUPAC Name: (E)-3-[2,6-dichloro-4-[[4-[3-(2-hexoxyethyl)-2-methoxyphenyl]-1,3-thiazol-2-yl]carbamoyl]phenyl]-2-methylprop-2-enoic acid Traditional Name: (E)-3-[2,6-dichloro-4-[[4-[3-(2-hexoxyethyl)-2-methoxy-phenyl]thiazol-2-yl]carbamoyl]phenyl]-2-methyl-acrylic acid Formula: C29H32Cl2N2O5S MolecularWeight: 591.54578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCCC1=CC=CC(=C1OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)Cl)C=C(C)C(=O)O)Cl

Isomeric SMILES

CCCCCCOCCC1=CC=CC(=C1OC)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)Cl)/C=C(\C)/C(=O)O)Cl

InChI

InChI=1S/C29H32Cl2N2O5S/c1-4-5-6-7-12-38-13-11-19-9-8-10-21(26(19)37-3)25-17-39-29(32-25)33-27(34)20-15-23(30)22(24(31)16-20)14-18(2)28(35)36/h8-10,14-17H,4-7,11-13H2,1-3H3,(H,35,36)(H,32,33,34)/b18-14+