S-tert-butyl 6-methyl-1-prop-2-enyl-2-prop-2-ynoxy-3,4-dihydro-2H-pyridine-5-carbothioate

Systemtic Name: S-tert-butyl 6-methyl-1-prop-2-enyl-2-prop-2-ynoxy-3,4-dihydro-2H-pyridine-5-carbothioate Openeye Name: S-tert-butyl 1-allyl-6-methyl-2-prop-2-ynoxy-3,4-dihydro-2H-pyridine-5-carbothioate CAS Name: 6-methyl-1-prop-2-enyl-2-prop-2-ynoxy-3,4-dihydro-2H-pyridine-5-carbothioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 6-methyl-1-prop-2-enyl-2-prop-2-ynoxy-3,4-dihydro-2H-pyridine-5-carbothioate Traditional Name: 1-allyl-6-methyl-2-propargyloxy-3,4-dihydro-2H-pyridine-5-carbothioic acid S-tert-butyl ester Formula: C17H25NO2S MolecularWeight: 307.4509

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CCC(N1CC=C)OCC#C)C(=O)SC(C)(C)C

Isomeric SMILES

CC1=C(CCC(N1CC=C)OCC#C)C(=O)SC(C)(C)C

InChI

InChI=1S/C17H25NO2S/c1-7-11-18-13(3)14(16(19)21-17(4,5)6)9-10-15(18)20-12-8-2/h2,7,15H,1,9-12H2,3-6H3