5-[(3-aminocarbonyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: 5-[(3-aminocarbonyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[(3-carbamoyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[(3-carbamoyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[(3-carbamoyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[(3-carbamoyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide Formula: C20H18FN5O2S MolecularWeight: 411.452623

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)CC3=NN=C(S3)C(=O)NC4=CC=C(C=C4)F)C(=O)N

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)CC3=NN=C(S3)C(=O)NC4=CC=C(C=C4)F)C(=O)N

InChI

InChI=1S/C20H18FN5O2S/c21-14-5-7-15(8-6-14)23-19(28)20-25-24-17(29-20)11-26-10-13-4-2-1-3-12(13)9-16(26)18(22)27/h1-8,16H,9-11H2,(H2,22,27)(H,23,28)