2-[(7-cyclohexyl-6-phenyl-pyrazolo[1,5-a]pyrimidin-3-yl)carbonylamino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[(7-cyclohexyl-6-phenyl-pyrazolo[1,5-a]pyrimidin-3-yl)carbonylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[(7-cyclohexyl-6-phenyl-pyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[(7-cyclohexyl-6-phenyl-3-pyrazolo[1,5-a]pyrimidinyl)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[(7-cyclohexyl-6-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[(7-cyclohexyl-6-phenyl-pyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]-3-(1H-indol-3-yl)propionic acid Formula: C30H29N5O3 MolecularWeight: 507.58296

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C=NC3=C(C=NN23)C(=O)NC(CC4=CNC5=CC=CC=C54)C(=O)O)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)C2=C(C=NC3=C(C=NN23)C(=O)NC(CC4=CNC5=CC=CC=C54)C(=O)O)C6=CC=CC=C6

InChI

InChI=1S/C30H29N5O3/c36-29(34-26(30(37)38)15-21-16-31-25-14-8-7-13-22(21)25)24-18-33-35-27(20-11-5-2-6-12-20)23(17-32-28(24)35)19-9-3-1-4-10-19/h1,3-4,7-10,13-14,16-18,20,26,31H,2,5-6,11-12,15H2,(H,34,36)(H,37,38)