N1-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]-N4,N4-diethyl-2-methyl-benzene-1,4-diamine

Systemtic Name: N1-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]-N4,N4-diethyl-2-methyl-benzene-1,4-diamine Openeye Name: N1-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]-N4,N4-diethyl-2-methyl-benzene-1,4-diamine CAS Name: N1-[5-(4-bromophenyl)-4-thieno[2,3-d]pyrimidinyl]-N4,N4-diethyl-2-methylbenzene-1,4-diamine IUPAC Name: 1-N-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]-4-N,4-N-diethyl-2-methylbenzene-1,4-diamine Traditional Name: [4-[[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]-3-methyl-phenyl]-diethyl-amine Formula: C23H23BrN4S MolecularWeight: 467.42452

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)NC2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)NC2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C23H23BrN4S/c1-4-28(5-2)18-10-11-20(15(3)12-18)27-22-21-19(13-29-23(21)26-14-25-22)16-6-8-17(24)9-7-16/h6-14H,4-5H2,1-3H3,(H,25,26,27)