5-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-amine

Systemtic Name: 5-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-amine Openeye Name: 4-allyl-5-[[3-(p-tolyl)isoxazol-5-yl]methylsulfanyl]-1,2,4-triazol-3-amine CAS Name: 5-[[3-(4-methylphenyl)-5-isoxazolyl]methylthio]-4-prop-2-enyl-1,2,4-triazol-3-amine IUPAC Name: 5-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-amine Traditional Name: [4-allyl-5-[[3-(p-tolyl)isoxazol-5-yl]methylthio]-1,2,4-triazol-3-yl]amine Formula: C16H17N5OS MolecularWeight: 327.40408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=C2)CSC3=NN=C(N3CC=C)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=C2)CSC3=NN=C(N3CC=C)N

InChI

InChI=1S/C16H17N5OS/c1-3-8-21-15(17)18-19-16(21)23-10-13-9-14(20-22-13)12-6-4-11(2)5-7-12/h3-7,9H,1,8,10H2,2H3,(H2,17,18)