(3-bromanyl-5-ethoxy-4-prop-2-ynoxy-phenyl)-piperidin-1-yl-methanethione

Systemtic Name: (3-bromanyl-5-ethoxy-4-prop-2-ynoxy-phenyl)-piperidin-1-yl-methanethione Openeye Name: (3-bromo-5-ethoxy-4-prop-2-ynoxy-phenyl)-(1-piperidyl)methanethione CAS Name: (3-bromo-5-ethoxy-4-prop-2-ynoxyphenyl)-(1-piperidinyl)methanethione IUPAC Name: (3-bromo-5-ethoxy-4-prop-2-ynoxyphenyl)-piperidin-1-ylmethanethione Traditional Name: (3-bromo-5-ethoxy-4-propargyloxy-phenyl)-piperidino-methanethione Formula: C17H20BrNO2S MolecularWeight: 382.3152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=S)N2CCCCC2)Br)OCC#C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=S)N2CCCCC2)Br)OCC#C

InChI

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