6-azanyl-5-[2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]ethanoyl]-3-methyl-1-(phenylmethyl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]ethanoyl]-3-methyl-1-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: 6-amino-1-benzyl-5-[2-[(5-bromo-2-thienyl)methyl-ethyl-amino]acetyl]-3-methyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[(5-bromo-2-thiophenyl)methyl-ethylamino]-1-oxoethyl]-3-methyl-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-1-benzyl-5-[2-[(5-bromothiophen-2-yl)methyl-ethylamino]acetyl]-3-methylpyrimidine-2,4-dione Traditional Name: 6-amino-1-benzyl-5-[2-[(5-bromo-2-thienyl)methyl-ethyl-amino]acetyl]-3-methyl-pyrimidine-2,4-quinone Formula: C21H23BrN4O3S MolecularWeight: 491.40132

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Br)CC(=O)C2=C(N(C(=O)N(C2=O)C)CC3=CC=CC=C3)N

Isomeric SMILES

CCN(CC1=CC=C(S1)Br)CC(=O)C2=C(N(C(=O)N(C2=O)C)CC3=CC=CC=C3)N

InChI

InChI=1S/C21H23BrN4O3S/c1-3-25(12-15-9-10-17(22)30-15)13-16(27)18-19(23)26(21(29)24(2)20(18)28)11-14-7-5-4-6-8-14/h4-10H,3,11-13,23H2,1-2H3