[2-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-(4-methylpiperidin-1-yl)methanethione

Systemtic Name: [2-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-(4-methylpiperidin-1-yl)methanethione Openeye Name: [2-bromo-5-methoxy-4-(p-tolylmethoxy)phenyl]-(4-methyl-1-piperidyl)methanethione CAS Name: [2-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-(4-methyl-1-piperidinyl)methanethione IUPAC Name: [2-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-(4-methylpiperidin-1-yl)methanethione Traditional Name: [2-bromo-5-methoxy-4-(4-methylbenzyl)oxy-phenyl]-(4-methylpiperidino)methanethione Formula: C22H26BrNO2S MolecularWeight: 448.41634

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)C2=CC(=C(C=C2Br)OCC3=CC=C(C=C3)C)OC

Isomeric SMILES

CC1CCN(CC1)C(=S)C2=CC(=C(C=C2Br)OCC3=CC=C(C=C3)C)OC

InChI

InChI=1S/C22H26BrNO2S/c1-15-4-6-17(7-5-15)14-26-21-13-19(23)18(12-20(21)25-3)22(27)24-10-8-16(2)9-11-24/h4-7,12-13,16H,8-11,14H2,1-3H3