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

Systemtic Name: 2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]acetamide Formula: C18H18N4O2S2 MolecularWeight: 386.49112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O2S2/c1-3-10-25-18-21-20-17(26-18)19-16(24)11-15-14-7-5-4-6-13(14)8-9-22(15)12(2)23/h3-9,15H,1,10-11H2,2H3,(H,19,20,24)/t15-/m1/s1