4-cyclopropyl-3-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-cyclopropyl-3-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-cyclopropyl-3-[[5-(2-thienyl)isoxazol-3-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-cyclopropyl-3-[(5-thiophen-2-yl-3-isoxazolyl)methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-cyclopropyl-3-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-cyclopropyl-3-[[5-(2-thienyl)isoxazol-3-yl]methylthio]-1H-1,2,4-triazol-5-one Formula: C13H12N4O2S2 MolecularWeight: 320.38998

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)NN=C2SCC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

C1CC1N2C(=O)NN=C2SCC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C13H12N4O2S2/c18-12-14-15-13(17(12)9-3-4-9)21-7-8-6-10(19-16-8)11-2-1-5-20-11/h1-2,5-6,9H,3-4,7H2,(H,14,18)