(5-azanyl-3-methylsulfanyl-1,2,4-triazol-1-yl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone

Systemtic Name: (5-azanyl-3-methylsulfanyl-1,2,4-triazol-1-yl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone Openeye Name: (5-amino-3-methylsulfanyl-1,2,4-triazol-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)methanone CAS Name: [5-amino-3-(methylthio)-1,2,4-triazol-1-yl]-(5-methyl-3-phenyl-4-isoxazolyl)methanone IUPAC Name: (5-amino-3-methylsulfanyl-1,2,4-triazol-1-yl)-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone Traditional Name: [5-amino-3-(methylthio)-1,2,4-triazol-1-yl]-(5-methyl-3-phenyl-isoxazol-4-yl)methanone Formula: C14H13N5O2S MolecularWeight: 315.35032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N3C(=NC(=N3)SC)N

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N3C(=NC(=N3)SC)N

InChI

InChI=1S/C14H13N5O2S/c1-8-10(11(18-21-8)9-6-4-3-5-7-9)12(20)19-13(15)16-14(17-19)22-2/h3-7H,1-2H3,(H2,15,16,17)