4-azanyl-3-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-6-methyl-1,2,4-triazin-5-one

Systemtic Name: 4-azanyl-3-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-6-methyl-1,2,4-triazin-5-one Openeye Name: 4-amino-3-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-6-methyl-1,2,4-triazin-5-one CAS Name: 4-amino-3-[(1,3-diphenyl-4-pyrazolyl)methylthio]-6-methyl-1,2,4-triazin-5-one IUPAC Name: 4-amino-3-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-6-methyl-1,2,4-triazin-5-one Traditional Name: 4-amino-3-[(1,3-diphenylpyrazol-4-yl)methylthio]-6-methyl-1,2,4-triazin-5-one Formula: C20H18N6OS MolecularWeight: 390.46152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N(C1=O)N)SCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(N(C1=O)N)SCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H18N6OS/c1-14-19(27)26(21)20(23-22-14)28-13-16-12-25(17-10-6-3-7-11-17)24-18(16)15-8-4-2-5-9-15/h2-12H,13,21H2,1H3