ethyl 5-[(2-methylsulfanyl-1,3-thiazol-4-yl)carbonyl]-1-phenethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate

Systemtic Name: ethyl 5-[(2-methylsulfanyl-1,3-thiazol-4-yl)carbonyl]-1-phenethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Openeye Name: ethyl 5-(2-methylsulfanylthiazole-4-carbonyl)-1-phenethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate CAS Name: 5-[[2-(methylthio)-4-thiazolyl]-oxomethyl]-1-phenethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-methylsulfanyl-1,3-thiazole-4-carbonyl)-1-phenethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Traditional Name: 5-[2-(methylthio)thiazole-4-carbonyl]-1-phenethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1CN(CC2)C(=O)C3=CSC(=N3)SC)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1CN(CC2)C(=O)C3=CSC(=N3)SC)CCC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3S2/c1-3-29-21(28)19-16-13-25(20(27)17-14-31-22(23-17)30-2)11-10-18(16)26(24-19)12-9-15-7-5-4-6-8-15/h4-8,14H,3,9-13H2,1-2H3