6-azanyl-5-(1,3-benzothiazol-2-ylsulfanyl)-1-ethyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-(1,3-benzothiazol-2-ylsulfanyl)-1-ethyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-1-ethyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-(1,3-benzothiazol-2-ylthio)-1-ethylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-(1,3-benzothiazol-2-ylsulfanyl)-1-ethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-(1,3-benzothiazol-2-ylthio)-1-ethyl-pyrimidine-2,4-quinone Formula: C13H12N4O2S2 MolecularWeight: 320.38998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=O)NC1=O)SC2=NC3=CC=CC=C3S2)N

Isomeric SMILES

CCN1C(=C(C(=O)NC1=O)SC2=NC3=CC=CC=C3S2)N

InChI

InChI=1S/C13H12N4O2S2/c1-2-17-10(14)9(11(18)16-12(17)19)21-13-15-7-5-3-4-6-8(7)20-13/h3-6H,2,14H2,1H3,(H,16,18,19)