3,4-dihydro-1H-isoquinolin-2-yl-[2-[3,5-dimethyl-4-(phenylmethyl)pyrazol-1-yl]-4-methyl-1,3-thiazol-5-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-[3,5-dimethyl-4-(phenylmethyl)pyrazol-1-yl]-4-methyl-1,3-thiazol-5-yl]methanone Openeye Name: [2-(4-benzyl-3,5-dimethyl-pyrazol-1-yl)-4-methyl-thiazol-5-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-[3,5-dimethyl-4-(phenylmethyl)-1-pyrazolyl]-4-methyl-5-thiazolyl]methanone IUPAC Name: [2-(4-benzyl-3,5-dimethylpyrazol-1-yl)-4-methyl-1,3-thiazol-5-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [2-(4-benzyl-3,5-dimethyl-pyrazol-1-yl)-4-methyl-thiazol-5-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C26H26N4OS MolecularWeight: 442.57584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C(=C(C(=N2)C)CC3=CC=CC=C3)C)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=C(SC(=N1)N2C(=C(C(=N2)C)CC3=CC=CC=C3)C)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C26H26N4OS/c1-17-23(15-20-9-5-4-6-10-20)19(3)30(28-17)26-27-18(2)24(32-26)25(31)29-14-13-21-11-7-8-12-22(21)16-29/h4-12H,13-16H2,1-3H3