1-[2-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)-4-methyl-1,3-thiazol-5-yl]ethanone hydrochloride

Systemtic Name: 1-[2-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)-4-methyl-1,3-thiazol-5-yl]ethanone hydrochloride Openeye Name: 1-[2-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)-4-methyl-thiazol-5-yl]ethanone hydrochloride CAS Name: 1-[2-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)-4-methyl-5-thiazolyl]ethanone hydrochloride IUPAC Name: 1-[2-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)-4-methyl-1,3-thiazol-5-yl]ethanone hydrochloride Traditional Name: 1-[2-(3,5-diphenyl-2-pyrazolin-1-yl)-4-methyl-thiazol-5-yl]ethanone hydrochloride Formula: C21H20ClN3OS MolecularWeight: 397.921

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C(CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C.Cl

Isomeric SMILES

CC1=C(SC(=N1)N2C(CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C.Cl

InChI

InChI=1S/C21H19N3OS.ClH/c1-14-20(15(2)25)26-21(22-14)24-19(17-11-7-4-8-12-17)13-18(23-24)16-9-5-3-6-10-16;/h3-12,19H,13H2,1-2H3;1H