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

Systemtic Name: 6-azanyl-3-methyl-5-[2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylethanoyl]-1-propyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-(1-isobutylbenzimidazol-2-yl)sulfanylacetyl]-3-methyl-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-3-methyl-5-[2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]-1-oxoethyl]-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-3-methyl-5-[2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylacetyl]-1-propylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[(1-isobutylbenzimidazol-2-yl)thio]acetyl]-3-methyl-1-propyl-pyrimidine-2,4-quinone Formula: C21H27N5O3S MolecularWeight: 429.53578

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC3=CC=CC=C3N2CC(C)C)N

Isomeric SMILES

CCCN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC3=CC=CC=C3N2CC(C)C)N

InChI

InChI=1S/C21H27N5O3S/c1-5-10-25-18(22)17(19(28)24(4)21(25)29)16(27)12-30-20-23-14-8-6-7-9-15(14)26(20)11-13(2)3/h6-9,13H,5,10-12,22H2,1-4H3