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

Systemtic Name: 6-[[5-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione Openeye Name: 6-[[5-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione CAS Name: 6-[[5-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-4-phenyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione IUPAC Name: 6-[[5-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione Traditional Name: 6-[[5-[(2-keto-2-pyrrolidino-ethyl)thio]-4-phenyl-1,2,4-triazol-3-yl]methyl]uracil Formula: C19H20N6O3S MolecularWeight: 412.4655

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)CC4=CC(=O)NC(=O)N4

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)CC4=CC(=O)NC(=O)N4

InChI

InChI=1S/C19H20N6O3S/c26-16-11-13(20-18(28)21-16)10-15-22-23-19(25(15)14-6-2-1-3-7-14)29-12-17(27)24-8-4-5-9-24/h1-3,6-7,11H,4-5,8-10,12H2,(H2,20,21,26,28)