[5-[(4,4-diethyl-5H-1,3-thiazol-2-yl)amino]pyridin-2-yl] 3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: [5-[(4,4-diethyl-5H-1,3-thiazol-2-yl)amino]pyridin-2-yl] 3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: [5-[(4,4-diethyl-5H-thiazol-2-yl)amino]-2-pyridyl] 3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 3,4-dihydro-1H-isoquinoline-2-carboxylic acid [5-[(4,4-diethyl-5H-thiazol-2-yl)amino]-2-pyridinyl] ester IUPAC Name: [5-[(4,4-diethyl-5H-1,3-thiazol-2-yl)amino]pyridin-2-yl] 3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 3,4-dihydro-1H-isoquinoline-2-carboxylic acid [5-[(4,4-diethyl-2-thiazolin-2-yl)amino]-2-pyridyl] ester Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CSC(=N1)NC2=CN=C(C=C2)OC(=O)N3CCC4=CC=CC=C4C3)CC

Isomeric SMILES

CCC1(CSC(=N1)NC2=CN=C(C=C2)OC(=O)N3CCC4=CC=CC=C4C3)CC

InChI

InChI=1S/C22H26N4O2S/c1-3-22(4-2)15-29-20(25-22)24-18-9-10-19(23-13-18)28-21(27)26-12-11-16-7-5-6-8-17(16)14-26/h5-10,13H,3-4,11-12,14-15H2,1-2H3,(H,24,25)