4-azanyl-3-phenacylsulfanyl-6-propan-2-yl-1,2,4-triazin-5-one

Systemtic Name: 4-azanyl-3-phenacylsulfanyl-6-propan-2-yl-1,2,4-triazin-5-one Openeye Name: 4-amino-6-isopropyl-3-phenacylsulfanyl-1,2,4-triazin-5-one CAS Name: 4-amino-3-(phenacylthio)-6-propan-2-yl-1,2,4-triazin-5-one IUPAC Name: 4-amino-3-phenacylsulfanyl-6-propan-2-yl-1,2,4-triazin-5-one Traditional Name: 4-amino-6-isopropyl-3-(phenacylthio)-1,2,4-triazin-5-one Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N(C1=O)N)SCC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)C1=NN=C(N(C1=O)N)SCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H16N4O2S/c1-9(2)12-13(20)18(15)14(17-16-12)21-8-11(19)10-6-4-3-5-7-10/h3-7,9H,8,15H2,1-2H3