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

Systemtic Name: 6-azanyl-5-[2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-1-methyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-1-methyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-1-methylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-1-methylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]-1-methyl-pyrimidine-2,4-quinone Formula: C17H17N7O3S MolecularWeight: 399.42698

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)NC1=O)C(=O)CSC2=NN=C(N2C3CC3)C4=CC=NC=C4)N

Isomeric SMILES

CN1C(=C(C(=O)NC1=O)C(=O)CSC2=NN=C(N2C3CC3)C4=CC=NC=C4)N

InChI

InChI=1S/C17H17N7O3S/c1-23-13(18)12(15(26)20-16(23)27)11(25)8-28-17-22-21-14(24(17)10-2-3-10)9-4-6-19-7-5-9/h4-7,10H,2-3,8,18H2,1H3,(H,20,26,27)