6-[(5-butylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]-1H-pyrimidine-2,4-dione

Systemtic Name: 6-[(5-butylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]-1H-pyrimidine-2,4-dione Openeye Name: 6-[(5-butylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]-1H-pyrimidine-2,4-dione CAS Name: 6-[[5-(butylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione IUPAC Name: 6-[(5-butylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]-1H-pyrimidine-2,4-dione Traditional Name: 6-[[5-(butylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]uracil Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(N1C2=CC=CC=C2)CC3=CC(=O)NC(=O)N3

Isomeric SMILES

CCCCSC1=NN=C(N1C2=CC=CC=C2)CC3=CC(=O)NC(=O)N3

InChI

InChI=1S/C17H19N5O2S/c1-2-3-9-25-17-21-20-14(22(17)13-7-5-4-6-8-13)10-12-11-15(23)19-16(24)18-12/h4-8,11H,2-3,9-10H2,1H3,(H2,18,19,23,24)