6-azanyl-5-[2-(4-bromophenyl)sulfonylethyl-methyl-amino]-1-butyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-(4-bromophenyl)sulfonylethyl-methyl-amino]-1-butyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-(4-bromophenyl)sulfonylethyl-methyl-amino]-1-butyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-(4-bromophenyl)sulfonylethyl-methylamino]-1-butylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-(4-bromophenyl)sulfonylethyl-methylamino]-1-butylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-brosylethyl(methyl)amino]-1-butyl-pyrimidine-2,4-quinone Formula: C17H23BrN4O4S MolecularWeight: 459.35792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C)CCS(=O)(=O)C2=CC=C(C=C2)Br)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C)CCS(=O)(=O)C2=CC=C(C=C2)Br)N

InChI

InChI=1S/C17H23BrN4O4S/c1-3-4-9-22-15(19)14(16(23)20-17(22)24)21(2)10-11-27(25,26)13-7-5-12(18)6-8-13/h5-8H,3-4,9-11,19H2,1-2H3,(H,20,23,24)