2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: 2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-(5-benzyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-(5-benzyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-(5-benzyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=NN=C(S3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2[C@H]1CC(=O)NC3=NN=C(S3)CC4=CC=CC=C4

InChI

InChI=1S/C22H20N4O2S/c1-15(27)26-12-11-17-9-5-6-10-18(17)19(26)14-20(28)23-22-25-24-21(29-22)13-16-7-3-2-4-8-16/h2-12,19H,13-14H2,1H3,(H,23,25,28)/t19-/m1/s1