N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]pyrazine-2-carboxamide

Systemtic Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]pyrazine-2-carboxamide Openeye Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]thiazol-2-yl]pyrazine-2-carboxamide CAS Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-thiazolyl]-2-pyrazinecarboxamide IUPAC Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1,3-thiazol-2-yl]pyrazine-2-carboxamide Traditional Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thiazol-2-yl]pyrazinamide Formula: C21H21N5O4S MolecularWeight: 439.48754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CC3=CSC(=N3)NC(=O)C4=NC=CN=C4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CC3=CSC(=N3)NC(=O)C4=NC=CN=C4)OC

InChI

InChI=1S/C21H21N5O4S/c1-29-17-7-13-3-6-26(11-14(13)8-18(17)30-2)19(27)9-15-12-31-21(24-15)25-20(28)16-10-22-4-5-23-16/h4-5,7-8,10,12H,3,6,9,11H2,1-2H3,(H,24,25,28)