2-[2-[[5-(2-cyclopentylethyl)-4-(2,5-dimethoxy-4-methyl-phenyl)pyrimidin-2-yl]carbamoyl]indol-1-yl]ethanoic acid

Systemtic Name: 2-[2-[[5-(2-cyclopentylethyl)-4-(2,5-dimethoxy-4-methyl-phenyl)pyrimidin-2-yl]carbamoyl]indol-1-yl]ethanoic acid Openeye Name: 2-[2-[[5-(2-cyclopentylethyl)-4-(2,5-dimethoxy-4-methyl-phenyl)pyrimidin-2-yl]carbamoyl]indol-1-yl]acetic acid CAS Name: 2-[2-[[[5-(2-cyclopentylethyl)-4-(2,5-dimethoxy-4-methylphenyl)-2-pyrimidinyl]amino]-oxomethyl]-1-indolyl]acetic acid IUPAC Name: 2-[2-[[5-(2-cyclopentylethyl)-4-(2,5-dimethoxy-4-methylphenyl)pyrimidin-2-yl]carbamoyl]indol-1-yl]acetic acid Traditional Name: 2-[2-[[5-(2-cyclopentylethyl)-4-(2,5-dimethoxy-4-methyl-phenyl)pyrimidin-2-yl]carbamoyl]indol-1-yl]acetic acid Formula: C31H34N4O5 MolecularWeight: 542.62546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)OC)C2=NC(=NC=C2CCC3CCCC3)NC(=O)C4=CC5=CC=CC=C5N4CC(=O)O)OC

Isomeric SMILES

CC1=C(C=C(C(=C1)OC)C2=NC(=NC=C2CCC3CCCC3)NC(=O)C4=CC5=CC=CC=C5N4CC(=O)O)OC

InChI

InChI=1S/C31H34N4O5/c1-19-14-27(40-3)23(16-26(19)39-2)29-22(13-12-20-8-4-5-9-20)17-32-31(33-29)34-30(38)25-15-21-10-6-7-11-24(21)35(25)18-28(36)37/h6-7,10-11,14-17,20H,4-5,8-9,12-13,18H2,1-3H3,(H,36,37)(H,32,33,34,38)