4-[5-[[3-(2-dimethylaminoethyloxy)phenyl]methyl]-3-methyl-1-benzothiophen-2-yl]pyrimidin-2-amine

Systemtic Name: 4-[5-[[3-(2-dimethylaminoethyloxy)phenyl]methyl]-3-methyl-1-benzothiophen-2-yl]pyrimidin-2-amine Openeye Name: 4-[5-[[3-(2-dimethylaminoethyloxy)phenyl]methyl]-3-methyl-benzothiophen-2-yl]pyrimidin-2-amine CAS Name: 4-[5-[[3-(2-dimethylaminoethyloxy)phenyl]methyl]-3-methyl-1-benzothiophen-2-yl]-2-pyrimidinamine IUPAC Name: 4-[5-[[3-(2-dimethylaminoethyloxy)phenyl]methyl]-3-methyl-1-benzothiophen-2-yl]pyrimidin-2-amine Traditional Name: 2-[3-[[2-(2-aminopyrimidin-4-yl)-3-methyl-benzothiophen-5-yl]methyl]phenoxy]ethyl-dimethyl-amine Formula: C24H26N4OS MolecularWeight: 418.55444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)CC3=CC(=CC=C3)OCCN(C)C)C4=NC(=NC=C4)N

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)CC3=CC(=CC=C3)OCCN(C)C)C4=NC(=NC=C4)N

InChI

InChI=1S/C24H26N4OS/c1-16-20-15-18(13-17-5-4-6-19(14-17)29-12-11-28(2)3)7-8-22(20)30-23(16)21-9-10-26-24(25)27-21/h4-10,14-15H,11-13H2,1-3H3,(H2,25,26,27)