6-azanyl-5-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyl]-1-methyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyl]-1-methyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]-1-methyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]-1-methylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]-1-methylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-(1,3-benzoxazol-2-ylthio)acetyl]-1-methyl-pyrimidine-2,4-quinone Formula: C14H12N4O4S MolecularWeight: 332.33448

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)NC1=O)C(=O)CSC2=NC3=CC=CC=C3O2)N

Isomeric SMILES

CN1C(=C(C(=O)NC1=O)C(=O)CSC2=NC3=CC=CC=C3O2)N

InChI

InChI=1S/C14H12N4O4S/c1-18-11(15)10(12(20)17-13(18)21)8(19)6-23-14-16-7-4-2-3-5-9(7)22-14/h2-5H,6,15H2,1H3,(H,17,20,21)