4-chloranyl-2-methylsulfanyl-6-piperidin-1-yl-5-[(4-propan-2-yloxyphenyl)methyl]pyrimidine

Systemtic Name: 4-chloranyl-2-methylsulfanyl-6-piperidin-1-yl-5-[(4-propan-2-yloxyphenyl)methyl]pyrimidine Openeye Name: 4-chloro-5-[(4-isopropoxyphenyl)methyl]-2-methylsulfanyl-6-(1-piperidyl)pyrimidine CAS Name: 4-chloro-2-(methylthio)-6-(1-piperidinyl)-5-[(4-propan-2-yloxyphenyl)methyl]pyrimidine IUPAC Name: 4-chloro-2-methylsulfanyl-6-piperidin-1-yl-5-[(4-propan-2-yloxyphenyl)methyl]pyrimidine Traditional Name: 4-chloro-5-(4-isopropoxybenzyl)-2-(methylthio)-6-piperidino-pyrimidine Formula: C20H26ClN3OS MolecularWeight: 391.95794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CC2=C(N=C(N=C2Cl)SC)N3CCCCC3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CC2=C(N=C(N=C2Cl)SC)N3CCCCC3

InChI

InChI=1S/C20H26ClN3OS/c1-14(2)25-16-9-7-15(8-10-16)13-17-18(21)22-20(26-3)23-19(17)24-11-5-4-6-12-24/h7-10,14H,4-6,11-13H2,1-3H3