[(1S)-1-phenylethyl] 5-methyl-7-(3-methyl-1-benzothiophen-2-yl)-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: [(1S)-1-phenylethyl] 5-methyl-7-(3-methyl-1-benzothiophen-2-yl)-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: [(1S)-1-phenylethyl] 5-methyl-7-(3-methylbenzothiophen-2-yl)-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 5-methyl-7-(3-methyl-1-benzothiophen-2-yl)-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylic acid [(1S)-1-phenylethyl] ester IUPAC Name: [(1S)-1-phenylethyl] 5-methyl-7-(3-methyl-1-benzothiophen-2-yl)-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 5-methyl-7-(3-methylbenzothiophen-2-yl)-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylic acid [(1S)-1-phenylethyl] ester Formula: C25H23N3O2S MolecularWeight: 429.53402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C3C(=C(N=C4N3NC=C4)C)C(=O)OC(C)C5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C3C(=C(N=C4N3NC=C4)C)C(=O)O[C@@H](C)C5=CC=CC=C5

InChI

InChI=1S/C25H23N3O2S/c1-15-19-11-7-8-12-20(19)31-24(15)23-22(16(2)27-21-13-14-26-28(21)23)25(29)30-17(3)18-9-5-4-6-10-18/h4-14,17,23,26H,1-3H3/t17-,23?/m0/s1