2-[2-[[4-(4-chloranyl-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-7-methoxy-indol-1-yl]ethanoic acid

Systemtic Name: 2-[2-[[4-(4-chloranyl-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-7-methoxy-indol-1-yl]ethanoic acid Openeye Name: 2-[2-[[4-(4-chloro-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)thiazol-2-yl]carbamoyl]-7-methoxy-indol-1-yl]acetic acid CAS Name: 2-[2-[[[4-(4-chloro-2,5-dimethoxyphenyl)-5-(2-cyclohexylethyl)-2-thiazolyl]amino]-oxomethyl]-7-methoxy-1-indolyl]acetic acid IUPAC Name: 2-[2-[[4-(4-chloro-2,5-dimethoxyphenyl)-5-(2-cyclohexylethyl)-1,3-thiazol-2-yl]carbamoyl]-7-methoxyindol-1-yl]acetic acid Traditional Name: 2-[2-[[4-(4-chloro-2,5-dimethoxy-phenyl)-5-(2-cyclohexylethyl)thiazol-2-yl]carbamoyl]-7-methoxy-indol-1-yl]acetic acid Formula: C31H34ClN3O6S MolecularWeight: 612.13616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1N(C(=C2)C(=O)NC3=NC(=C(S3)CCC4CCCCC4)C5=CC(=C(C=C5OC)Cl)OC)CC(=O)O

Isomeric SMILES

COC1=CC=CC2=C1N(C(=C2)C(=O)NC3=NC(=C(S3)CCC4CCCCC4)C5=CC(=C(C=C5OC)Cl)OC)CC(=O)O

InChI

InChI=1S/C31H34ClN3O6S/c1-39-23-11-7-10-19-14-22(35(29(19)23)17-27(36)37)30(38)34-31-33-28(20-15-25(41-3)21(32)16-24(20)40-2)26(42-31)13-12-18-8-5-4-6-9-18/h7,10-11,14-16,18H,4-6,8-9,12-13,17H2,1-3H3,(H,36,37)(H,33,34,38)