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

Systemtic Name: 6-azanyl-1-cyclopropyl-5-[2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-cyclopropyl-5-[2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1-cyclopropyl-5-[1-oxo-2-[(4-pentyl-1,2,4-triazol-3-yl)thio]ethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-cyclopropyl-5-[2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[(4-amyl-1,2,4-triazol-3-yl)thio]acetyl]-1-cyclopropyl-pyrimidine-2,4-quinone Formula: C16H22N6O3S MolecularWeight: 378.44928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=NN=C1SCC(=O)C2=C(N(C(=O)NC2=O)C3CC3)N

Isomeric SMILES

CCCCCN1C=NN=C1SCC(=O)C2=C(N(C(=O)NC2=O)C3CC3)N

InChI

InChI=1S/C16H22N6O3S/c1-2-3-4-7-21-9-18-20-16(21)26-8-11(23)12-13(17)22(10-5-6-10)15(25)19-14(12)24/h9-10H,2-8,17H2,1H3,(H,19,24,25)