(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)-(4-methylpiperidin-1-yl)methanethione

Systemtic Name: (3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)-(4-methylpiperidin-1-yl)methanethione Openeye Name: (3-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)-(4-methyl-1-piperidyl)methanethione CAS Name: (3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)-(4-methyl-1-piperidinyl)methanethione IUPAC Name: (3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)-(4-methylpiperidin-1-yl)methanethione Traditional Name: (3-bromo-5-methoxy-4-propargyloxy-phenyl)-(4-methylpiperidino)methanethione Formula: C17H20BrNO2S MolecularWeight: 382.3152

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)C2=CC(=C(C(=C2)Br)OCC#C)OC

Isomeric SMILES

CC1CCN(CC1)C(=S)C2=CC(=C(C(=C2)Br)OCC#C)OC

InChI

InChI=1S/C17H20BrNO2S/c1-4-9-21-16-14(18)10-13(11-15(16)20-3)17(22)19-7-5-12(2)6-8-19/h1,10-12H,5-9H2,2-3H3