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

Systemtic Name: 6-azanyl-5-[2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]ethanoyl]-1-propyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[(5-bromo-2-thienyl)methyl-ethyl-amino]acetyl]-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[(5-bromo-2-thiophenyl)methyl-ethylamino]-1-oxoethyl]-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[(5-bromothiophen-2-yl)methyl-ethylamino]acetyl]-1-propylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[(5-bromo-2-thienyl)methyl-ethyl-amino]acetyl]-1-propyl-pyrimidine-2,4-quinone Formula: C16H21BrN4O3S MolecularWeight: 429.33194

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C(=O)CN(CC)CC2=CC=C(S2)Br)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)C(=O)CN(CC)CC2=CC=C(S2)Br)N

InChI

InChI=1S/C16H21BrN4O3S/c1-3-7-21-14(18)13(15(23)19-16(21)24)11(22)9-20(4-2)8-10-5-6-12(17)25-10/h5-6H,3-4,7-9,18H2,1-2H3,(H,19,23,24)