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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=C(N(C(=O)NC2=O)C3CC3)N)C4=CC=NC=C4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=C(N(C(=O)NC2=O)C3CC3)N)C4=CC=NC=C4

InChI

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