4-oxidanylidene-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-3-propyl-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]-3-propyl-1-phthalazinecarboxamide IUPAC Name: 4-oxo-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-3-propylphthalazine-1-carboxamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C17H17N5O2S2 MolecularWeight: 387.47918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NN=C(S3)SCC=C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NN=C(S3)SCC=C

InChI

InChI=1S/C17H17N5O2S2/c1-3-9-22-15(24)12-8-6-5-7-11(12)13(21-22)14(23)18-16-19-20-17(26-16)25-10-4-2/h4-8H,2-3,9-10H2,1H3,(H,18,19,23)