2-methyl-N-[4-methyl-3-[1-[(4-pyridin-4-ylsulfanylphenyl)methyl]piperidin-4-yl]phenyl]propanamide

Systemtic Name: 2-methyl-N-[4-methyl-3-[1-[(4-pyridin-4-ylsulfanylphenyl)methyl]piperidin-4-yl]phenyl]propanamide Openeye Name: 2-methyl-N-[4-methyl-3-[1-[[4-(4-pyridylsulfanyl)phenyl]methyl]-4-piperidyl]phenyl]propanamide CAS Name: 2-methyl-N-[4-methyl-3-[1-[[4-(pyridin-4-ylthio)phenyl]methyl]-4-piperidinyl]phenyl]propanamide IUPAC Name: 2-methyl-N-[4-methyl-3-[1-[(4-pyridin-4-ylsulfanylphenyl)methyl]piperidin-4-yl]phenyl]propanamide Traditional Name: 2-methyl-N-[4-methyl-3-[1-[4-(4-pyridylthio)benzyl]-4-piperidyl]phenyl]propionamide Formula: C28H33N3OS MolecularWeight: 459.64612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)C)C2CCN(CC2)CC3=CC=C(C=C3)SC4=CC=NC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)C)C2CCN(CC2)CC3=CC=C(C=C3)SC4=CC=NC=C4

InChI

InChI=1S/C28H33N3OS/c1-20(2)28(32)30-24-7-4-21(3)27(18-24)23-12-16-31(17-13-23)19-22-5-8-25(9-6-22)33-26-10-14-29-15-11-26/h4-11,14-15,18,20,23H,12-13,16-17,19H2,1-3H3,(H,30,32)