4-[1-[(2-ethoxyphenyl)methyl]piperidin-3-yl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine

Systemtic Name: 4-[1-[(2-ethoxyphenyl)methyl]piperidin-3-yl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine Openeye Name: 4-[1-[(2-ethoxyphenyl)methyl]-3-piperidyl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine CAS Name: 4-[1-[(2-ethoxyphenyl)methyl]-3-piperidinyl]-2-[2-(1-pyrrolidinyl)ethylthio]pyrimidine IUPAC Name: 4-[1-[(2-ethoxyphenyl)methyl]piperidin-3-yl]-2-(2-pyrrolidin-1-ylethylsulfanyl)pyrimidine Traditional Name: 4-[1-(2-ethoxybenzyl)-3-piperidyl]-2-(2-pyrrolidinoethylthio)pyrimidine Formula: C24H34N4OS MolecularWeight: 426.61796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN2CCCC(C2)C3=NC(=NC=C3)SCCN4CCCC4

Isomeric SMILES

CCOC1=CC=CC=C1CN2CCCC(C2)C3=NC(=NC=C3)SCCN4CCCC4

InChI

InChI=1S/C24H34N4OS/c1-2-29-23-10-4-3-8-21(23)19-28-15-7-9-20(18-28)22-11-12-25-24(26-22)30-17-16-27-13-5-6-14-27/h3-4,8,10-12,20H,2,5-7,9,13-19H2,1H3