[3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-piperidin-1-yl-methanethione

Systemtic Name: [3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-piperidin-1-yl-methanethione Openeye Name: [3-bromo-5-methoxy-4-(p-tolylmethoxy)phenyl]-(1-piperidyl)methanethione CAS Name: [3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-(1-piperidinyl)methanethione IUPAC Name: [3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-piperidin-1-ylmethanethione Traditional Name: [3-bromo-5-methoxy-4-(4-methylbenzyl)oxy-phenyl]-piperidino-methanethione Formula: C21H24BrNO2S MolecularWeight: 434.38976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)C(=S)N3CCCCC3)OC

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)C(=S)N3CCCCC3)OC

InChI

InChI=1S/C21H24BrNO2S/c1-15-6-8-16(9-7-15)14-25-20-18(22)12-17(13-19(20)24-2)21(26)23-10-4-3-5-11-23/h6-9,12-13H,3-5,10-11,14H2,1-2H3