(2S,4Z,9S)-9-methyl-2-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-2,3,6,7,8,9-hexahydrooxecin-10-one

Systemtic Name: (2S,4Z,9S)-9-methyl-2-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-2,3,6,7,8,9-hexahydrooxecin-10-one Openeye Name: (2S,4Z,9S)-9-methyl-2-[(E)-1-methyl-2-(2-methylthiazol-4-yl)vinyl]-2,3,6,7,8,9-hexahydrooxecin-10-one CAS Name: (2S,4Z,9S)-9-methyl-2-[(E)-1-(2-methyl-4-thiazolyl)prop-1-en-2-yl]-2,3,6,7,8,9-hexahydrooxecin-10-one IUPAC Name: (2S,4Z,9S)-9-methyl-2-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-2,3,6,7,8,9-hexahydrooxecin-10-one Traditional Name: (2S,4Z,9S)-9-methyl-2-[(E)-1-methyl-2-(2-methylthiazol-4-yl)vinyl]-2,3,6,7,8,9-hexahydrooxecin-10-one Formula: C17H23NO2S MolecularWeight: 305.43502

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC=CCC(OC1=O)C(=CC2=CSC(=N2)C)C

Isomeric SMILES

C[C@H]1CCC/C=C\C[C@H](OC1=O)/C(=C/C2=CSC(=N2)C)/C

InChI

InChI=1S/C17H23NO2S/c1-12-8-6-4-5-7-9-16(20-17(12)19)13(2)10-15-11-21-14(3)18-15/h5,7,10-12,16H,4,6,8-9H2,1-3H3/b7-5-,13-10+/t12-,16-/m0/s1