N-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]piperidin-4-yl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]piperidin-4-yl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-piperidyl]thiadiazole-4-carboxamide CAS Name: N-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-4-piperidinyl]-4-thiadiazolecarboxamide IUPAC Name: N-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidin-4-yl]thiadiazole-4-carboxamide Traditional Name: N-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-piperidyl]thiadiazole-4-carboxamide Formula: C20H25N5O4S MolecularWeight: 431.5086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3(CCNCC3)NC(=O)C4=CSN=N4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3(CCNCC3)NC(=O)C4=CSN=N4)OC

InChI

InChI=1S/C20H25N5O4S/c1-28-16-9-13-3-8-25(11-14(13)10-17(16)29-2)19(27)20(4-6-21-7-5-20)22-18(26)15-12-30-24-23-15/h9-10,12,21H,3-8,11H2,1-2H3,(H,22,26)