4-methyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: 4-methyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-1,2,3-thiadiazole-5-carboxamide Openeye Name: 4-methyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)thiadiazole-5-carboxamide CAS Name: 4-methyl-N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-5-thiadiazolecarboxamide IUPAC Name: 4-methyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)thiadiazole-5-carboxamide Traditional Name: 4-methyl-N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)thiadiazole-5-carboxamide Formula: C16H18N4O2S MolecularWeight: 330.40472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=C(N=NS3)C

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=C(N=NS3)C

InChI

InChI=1S/C16H18N4O2S/c1-3-14(21)20-7-6-11-4-5-13(8-12(11)9-20)17-16(22)15-10(2)18-19-23-15/h4-5,8H,3,6-7,9H2,1-2H3,(H,17,22)