(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-piperidin-1-yl-methanethione

Systemtic Name: (3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-piperidin-1-yl-methanethione Openeye Name: (4-benzyloxy-3-bromo-5-methoxy-phenyl)-(1-piperidyl)methanethione CAS Name: (3-bromo-5-methoxy-4-phenylmethoxyphenyl)-(1-piperidinyl)methanethione IUPAC Name: (3-bromo-5-methoxy-4-phenylmethoxyphenyl)-piperidin-1-ylmethanethione Traditional Name: (4-benzoxy-3-bromo-5-methoxy-phenyl)-piperidino-methanethione Formula: C20H22BrNO2S MolecularWeight: 420.36318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=S)N2CCCCC2)Br)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=S)N2CCCCC2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C20H22BrNO2S/c1-23-18-13-16(20(25)22-10-6-3-7-11-22)12-17(21)19(18)24-14-15-8-4-2-5-9-15/h2,4-5,8-9,12-13H,3,6-7,10-11,14H2,1H3