5-azanylidene-6-[(5-methylfuran-2-yl)methylidene]-2-(phenylmethylsulfanyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: 5-azanylidene-6-[(5-methylfuran-2-yl)methylidene]-2-(phenylmethylsulfanyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: 2-benzylsulfanyl-5-imino-6-[(5-methyl-2-furyl)methylene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: 5-imino-6-[(5-methyl-2-furanyl)methylidene]-2-(phenylmethylthio)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: 2-benzylsulfanyl-5-imino-6-[(5-methylfuran-2-yl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: 2-(benzylthio)-5-imino-6-[(5-methyl-2-furyl)methylene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C18H14N4O2S2 MolecularWeight: 382.45936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=C2C(=N)N3C(=NC2=O)SC(=N3)SCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(O1)C=C2C(=N)N3C(=NC2=O)SC(=N3)SCC4=CC=CC=C4

InChI

InChI=1S/C18H14N4O2S2/c1-11-7-8-13(24-11)9-14-15(19)22-17(20-16(14)23)26-18(21-22)25-10-12-5-3-2-4-6-12/h2-9,19H,10H2,1H3