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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SCC(=O)C3=C(N(C(=O)N(C3=O)C)C)N

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SCC(=O)C3=C(N(C(=O)N(C3=O)C)C)N

InChI

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