6-azanyl-3-methyl-5-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoyl]-1-(phenylmethyl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-3-methyl-5-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoyl]-1-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: 6-amino-1-benzyl-3-methyl-5-[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]pyrimidine-2,4-dione CAS Name: 6-amino-3-methyl-5-[2-[(1-methyl-2-benzimidazolyl)thio]-1-oxoethyl]-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-1-benzyl-3-methyl-5-[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-benzyl-3-methyl-5-[2-[(1-methylbenzimidazol-2-yl)thio]acetyl]pyrimidine-2,4-quinone Formula: C22H21N5O3S MolecularWeight: 435.49884

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCC(=O)C3=C(N(C(=O)N(C3=O)C)CC4=CC=CC=C4)N

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCC(=O)C3=C(N(C(=O)N(C3=O)C)CC4=CC=CC=C4)N

InChI

InChI=1S/C22H21N5O3S/c1-25-16-11-7-6-10-15(16)24-21(25)31-13-17(28)18-19(23)27(22(30)26(2)20(18)29)12-14-8-4-3-5-9-14/h3-11H,12-13,23H2,1-2H3