6-azanyl-5-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-1-methyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-1-methyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-1-methyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-1-methylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-1-methylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetyl]-1-methyl-pyrimidine-2,4-quinone Formula: C17H18N6O3S MolecularWeight: 386.42822

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)C2=C(N(C(=O)NC2=O)C)N)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)C2=C(N(C(=O)NC2=O)C)N)C3=CC=CC=C3

InChI

InChI=1S/C17H18N6O3S/c1-3-23-14(10-7-5-4-6-8-10)20-21-17(23)27-9-11(24)12-13(18)22(2)16(26)19-15(12)25/h4-8H,3,9,18H2,1-2H3,(H,19,25,26)