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

Systemtic Name: 4-propyl-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-1,2,3-thiadiazole-5-carboxamide Openeye Name: 4-propyl-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)thiadiazole-5-carboxamide CAS Name: 4-propyl-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-thiadiazolecarboxamide IUPAC Name: 4-propyl-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)thiadiazole-5-carboxamide Traditional Name: 4-propyl-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)thiadiazole-5-carboxamide Formula: C18H24N4O3S2 MolecularWeight: 408.53816

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SN=N1)C(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)CCC)C=C2

Isomeric SMILES

CCCC1=C(SN=N1)C(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)CCC)C=C2

InChI

InChI=1S/C18H24N4O3S2/c1-3-5-16-17(26-21-20-16)18(23)19-15-7-6-13-8-9-22(12-14(13)11-15)27(24,25)10-4-2/h6-7,11H,3-5,8-10,12H2,1-2H3,(H,19,23)