3-[5-but-3-yn-2-ylsulfanyl-2,4-bis(chloranyl)phenyl]-5-cyclopropyl-1,3,4-thiadiazol-2-one

Systemtic Name: 3-[5-but-3-yn-2-ylsulfanyl-2,4-bis(chloranyl)phenyl]-5-cyclopropyl-1,3,4-thiadiazol-2-one Openeye Name: 5-cyclopropyl-3-[2,4-dichloro-5-(1-methylprop-2-ynylsulfanyl)phenyl]-1,3,4-thiadiazol-2-one CAS Name: 3-[5-(but-3-yn-2-ylthio)-2,4-dichlorophenyl]-5-cyclopropyl-1,3,4-thiadiazol-2-one IUPAC Name: 3-(5-but-3-yn-2-ylsulfanyl-2,4-dichlorophenyl)-5-cyclopropyl-1,3,4-thiadiazol-2-one Traditional Name: 5-cyclopropyl-3-[2,4-dichloro-5-(1-methylprop-2-ynylthio)phenyl]-1,3,4-thiadiazol-2-one Formula: C15H12Cl2N2OS2 MolecularWeight: 371.30458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#C)SC1=C(C=C(C(=C1)N2C(=O)SC(=N2)C3CC3)Cl)Cl

Isomeric SMILES

CC(C#C)SC1=C(C=C(C(=C1)N2C(=O)SC(=N2)C3CC3)Cl)Cl

InChI

InChI=1S/C15H12Cl2N2OS2/c1-3-8(2)21-13-7-12(10(16)6-11(13)17)19-15(20)22-14(18-19)9-4-5-9/h1,6-9H,4-5H2,2H3