6-azanyl-5-[2-(1-hexylbenzimidazol-2-yl)sulfanylethanoyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-(1-hexylbenzimidazol-2-yl)sulfanylethanoyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-(1-hexylbenzimidazol-2-yl)sulfanylacetyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[(1-hexyl-2-benzimidazolyl)thio]-1-oxoethyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-(1-hexylbenzimidazol-2-yl)sulfanylacetyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[(1-hexylbenzimidazol-2-yl)thio]acetyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C21H27N5O3S MolecularWeight: 429.53578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)C3=C(N(C(=O)N(C3=O)C)C)N

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)C3=C(N(C(=O)N(C3=O)C)C)N

InChI

InChI=1S/C21H27N5O3S/c1-4-5-6-9-12-26-15-11-8-7-10-14(15)23-20(26)30-13-16(27)17-18(22)24(2)21(29)25(3)19(17)28/h7-8,10-11H,4-6,9,12-13,22H2,1-3H3