N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide

Systemtic Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide Openeye Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(3-methyl-4-oxo-phthalazin-1-yl)acetamide CAS Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-2-(3-methyl-4-oxo-1-phthalazinyl)acetamide IUPAC Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(3-methyl-4-oxophthalazin-1-yl)acetamide Traditional Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-2-(4-keto-3-methyl-phthalazin-1-yl)acetamide Formula: C17H19N5O2S2 MolecularWeight: 389.49506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(S1)NC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCCCSC1=NN=C(S1)NC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C17H19N5O2S2/c1-3-4-9-25-17-20-19-16(26-17)18-14(23)10-13-11-7-5-6-8-12(11)15(24)22(2)21-13/h5-8H,3-4,9-10H2,1-2H3,(H,18,19,23)