3-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)-N-(5-piperidin-1-ylisoquinolin-8-yl)propanamide

Systemtic Name: 3-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)-N-(5-piperidin-1-ylisoquinolin-8-yl)propanamide Openeye Name: 3-(4-methyl-2-oxo-thiazol-3-yl)-N-[5-(1-piperidyl)-8-isoquinolyl]propanamide CAS Name: 3-(4-methyl-2-oxo-3-thiazolyl)-N-[5-(1-piperidinyl)-8-isoquinolinyl]propanamide IUPAC Name: 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(5-piperidin-1-ylisoquinolin-8-yl)propanamide Traditional Name: 3-(2-keto-4-methyl-4-thiazolin-3-yl)-N-(5-piperidino-8-isoquinolyl)propionamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=O)N1CCC(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4

Isomeric SMILES

CC1=CSC(=O)N1CCC(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4

InChI

InChI=1S/C21H24N4O2S/c1-15-14-28-21(27)25(15)12-8-20(26)23-18-5-6-19(24-10-3-2-4-11-24)16-7-9-22-13-17(16)18/h5-7,9,13-14H,2-4,8,10-12H2,1H3,(H,23,26)