5-bromanyl-N2-[4-(2-diethylaminoethylsulfonyl)phenyl]-N4-prop-2-ynyl-pyrimidine-2,4-diamine

Systemtic Name: 5-bromanyl-N2-[4-(2-diethylaminoethylsulfonyl)phenyl]-N4-prop-2-ynyl-pyrimidine-2,4-diamine Openeye Name: 5-bromo-N2-[4-(2-diethylaminoethylsulfonyl)phenyl]-N4-prop-2-ynyl-pyrimidine-2,4-diamine CAS Name: 5-bromo-N2-[4-(2-diethylaminoethylsulfonyl)phenyl]-N4-prop-2-ynylpyrimidine-2,4-diamine IUPAC Name: 5-bromo-2-N-[4-(2-diethylaminoethylsulfonyl)phenyl]-4-N-prop-2-ynylpyrimidine-2,4-diamine Traditional Name: 2-[4-[[5-bromo-4-(propargylamino)pyrimidin-2-yl]amino]phenyl]sulfonylethyl-diethyl-amine Formula: C19H24BrN5O2S MolecularWeight: 466.39516

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCS(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)NCC#C)Br

Isomeric SMILES

CCN(CC)CCS(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)NCC#C)Br

InChI

InChI=1S/C19H24BrN5O2S/c1-4-11-21-18-17(20)14-22-19(24-18)23-15-7-9-16(10-8-15)28(26,27)13-12-25(5-2)6-3/h1,7-10,14H,5-6,11-13H2,2-3H3,(H2,21,22,23,24)