6-azanyl-3-methyl-1-(2-methylpropyl)-5-[2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-3-methyl-1-(2-methylpropyl)-5-[2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylethanoyl]pyrimidine-2,4-dione Openeye Name: 5-[2-(1-allylbenzimidazol-2-yl)sulfanylacetyl]-6-amino-1-isobutyl-3-methyl-pyrimidine-2,4-dione CAS Name: 6-amino-3-methyl-1-(2-methylpropyl)-5-[1-oxo-2-[(1-prop-2-enyl-2-benzimidazolyl)thio]ethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-3-methyl-1-(2-methylpropyl)-5-[2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetyl]pyrimidine-2,4-dione Traditional Name: 5-[2-[(1-allylbenzimidazol-2-yl)thio]acetyl]-6-amino-1-isobutyl-3-methyl-pyrimidine-2,4-quinone Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC3=CC=CC=C3N2CC=C)N

Isomeric SMILES

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC3=CC=CC=C3N2CC=C)N

InChI

InChI=1S/C21H25N5O3S/c1-5-10-25-15-9-7-6-8-14(15)23-20(25)30-12-16(27)17-18(22)26(11-13(2)3)21(29)24(4)19(17)28/h5-9,13H,1,10-12,22H2,2-4H3