6-azanyl-3-methyl-5-[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoyl]-1-(phenylmethyl)pyrimidine-2,4-dione

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)C3=C(N(C(=O)N(C3=O)C)CC4=CC=CC=C4)N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)C3=C(N(C(=O)N(C3=O)C)CC4=CC=CC=C4)N

InChI

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