N1-[5-(4-bromophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]-N4,N4-diethyl-benzene-1,4-diamine

Systemtic Name: N1-[5-(4-bromophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]-N4,N4-diethyl-benzene-1,4-diamine Openeye Name: N1-[5-(4-bromophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]-N4,N4-diethyl-benzene-1,4-diamine CAS Name: N1-[5-(4-bromophenyl)-6-methyl-4-thieno[2,3-d]pyrimidinyl]-N4,N4-diethylbenzene-1,4-diamine IUPAC Name: 1-N-[5-(4-bromophenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]-4-N,4-N-diethylbenzene-1,4-diamine Traditional Name: [4-[[5-(4-bromophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]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(=C(SC3=NC=N2)C)C4=CC=C(C=C4)Br

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC2=C3C(=C(SC3=NC=N2)C)C4=CC=C(C=C4)Br

InChI

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