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

Systemtic Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-propyl-1,2,3-thiadiazole-5-carboxamide Openeye Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-propyl-thiadiazole-5-carboxamide CAS Name: N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-propyl-5-thiadiazolecarboxamide IUPAC Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-propylthiadiazole-5-carboxamide Traditional Name: N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-propyl-thiadiazole-5-carboxamide Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O2S/c1-3-5-15-17(25-21-20-15)18(24)19-14-7-6-12-8-9-22(16(23)4-2)11-13(12)10-14/h6-7,10H,3-5,8-9,11H2,1-2H3,(H,19,24)