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

Systemtic Name: 6-azanyl-5-[2-[4-(ethylamino)quinazolin-2-yl]sulfanylethanoyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[4-(ethylamino)quinazolin-2-yl]sulfanylacetyl]-1-isobutyl-3-methyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[[4-(ethylamino)-2-quinazolinyl]thio]-1-oxoethyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[4-(ethylamino)quinazolin-2-yl]sulfanylacetyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[[4-(ethylamino)quinazolin-2-yl]thio]acetyl]-1-isobutyl-3-methyl-pyrimidine-2,4-quinone Formula: C21H26N6O3S MolecularWeight: 442.53454

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)C3=C(N(C(=O)N(C3=O)C)CC(C)C)N

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)C3=C(N(C(=O)N(C3=O)C)CC(C)C)N

InChI

InChI=1S/C21H26N6O3S/c1-5-23-18-13-8-6-7-9-14(13)24-20(25-18)31-11-15(28)16-17(22)27(10-12(2)3)21(30)26(4)19(16)29/h6-9,12H,5,10-11,22H2,1-4H3,(H,23,24,25)