4-[1-[2-(1-benzothiophen-3-yl)ethyl]piperidin-3-yl]-N-cyclopropyl-pyrimidin-2-amine

Systemtic Name: 4-[1-[2-(1-benzothiophen-3-yl)ethyl]piperidin-3-yl]-N-cyclopropyl-pyrimidin-2-amine Openeye Name: 4-[1-[2-(benzothiophen-3-yl)ethyl]-3-piperidyl]-N-cyclopropyl-pyrimidin-2-amine CAS Name: 4-[1-[2-(1-benzothiophen-3-yl)ethyl]-3-piperidinyl]-N-cyclopropyl-2-pyrimidinamine IUPAC Name: 4-[1-[2-(1-benzothiophen-3-yl)ethyl]piperidin-3-yl]-N-cyclopropylpyrimidin-2-amine Traditional Name: [4-[1-[2-(benzothiophen-3-yl)ethyl]-3-piperidyl]pyrimidin-2-yl]-cyclopropyl-amine Formula: C22H26N4S MolecularWeight: 378.53364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCC2=CSC3=CC=CC=C32)C4=NC(=NC=C4)NC5CC5

Isomeric SMILES

C1CC(CN(C1)CCC2=CSC3=CC=CC=C32)C4=NC(=NC=C4)NC5CC5

InChI

InChI=1S/C22H26N4S/c1-2-6-21-19(5-1)17(15-27-21)10-13-26-12-3-4-16(14-26)20-9-11-23-22(25-20)24-18-7-8-18/h1-2,5-6,9,11,15-16,18H,3-4,7-8,10,12-14H2,(H,23,24,25)