S-tert-butyl 3-ethenyl-7-methyl-5,9,10,10a-tetrahydro-2H-pyrido[2,1-b][1,3]oxazepine-8-carbothioate

Systemtic Name: S-tert-butyl 3-ethenyl-7-methyl-5,9,10,10a-tetrahydro-2H-pyrido[2,1-b][1,3]oxazepine-8-carbothioate Openeye Name: S-tert-butyl 7-methyl-3-vinyl-5,9,10,10a-tetrahydro-2H-pyrido[2,1-b][1,3]oxazepine-8-carbothioate CAS Name: 3-ethenyl-7-methyl-5,9,10,10a-tetrahydro-2H-pyrido[2,1-b][1,3]oxazepine-8-carbothioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 3-ethenyl-7-methyl-5,9,10,10a-tetrahydro-2H-pyrido[2,1-b][1,3]oxazepine-8-carbothioate Traditional Name: 7-methyl-3-vinyl-5,9,10,10a-tetrahydro-2H-pyrido[2,1-b][1,3]oxazepine-8-carbothioic acid S-tert-butyl ester Formula: C17H25NO2S MolecularWeight: 307.4509

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CCC2N1CC=C(CO2)C=C)C(=O)SC(C)(C)C

Isomeric SMILES

CC1=C(CCC2N1CC=C(CO2)C=C)C(=O)SC(C)(C)C

InChI

InChI=1S/C17H25NO2S/c1-6-13-9-10-18-12(2)14(7-8-15(18)20-11-13)16(19)21-17(3,4)5/h6,9,15H,1,7-8,10-11H2,2-5H3