4-[5-[(3-methoxyphenyl)-methyl-amino]-3-methyl-1-benzothiophen-2-yl]pyrimidin-2-amine

Systemtic Name: 4-[5-[(3-methoxyphenyl)-methyl-amino]-3-methyl-1-benzothiophen-2-yl]pyrimidin-2-amine Openeye Name: 4-[5-(3-methoxy-N-methyl-anilino)-3-methyl-benzothiophen-2-yl]pyrimidin-2-amine CAS Name: 4-[5-(3-methoxy-N-methylanilino)-3-methyl-1-benzothiophen-2-yl]-2-pyrimidinamine IUPAC Name: 4-[5-(3-methoxy-N-methylanilino)-3-methyl-1-benzothiophen-2-yl]pyrimidin-2-amine Traditional Name: [2-(2-aminopyrimidin-4-yl)-3-methyl-benzothiophen-5-yl]-(3-methoxyphenyl)-methyl-amine Formula: C21H20N4OS MolecularWeight: 376.4747

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4OS/c1-13-17-12-15(25(2)14-5-4-6-16(11-14)26-3)7-8-19(17)27-20(13)18-9-10-23-21(22)24-18/h4-12H,1-3H3,(H2,22,23,24)