N,N-dimethyl-2-[(Z)-[4-[(E)-4-methyl-3-oxidanyl-oct-1-en-6-ynyl]-5-oxidanyl-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]methyl]sulfanyl-ethanamide

Systemtic Name: N,N-dimethyl-2-[(Z)-[4-[(E)-4-methyl-3-oxidanyl-oct-1-en-6-ynyl]-5-oxidanyl-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]methyl]sulfanyl-ethanamide Openeye Name: 2-[(Z)-[5-hydroxy-4-[(E)-3-hydroxy-4-methyl-oct-1-en-6-ynyl]-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]methyl]sulfanyl-N,N-dimethyl-acetamide CAS Name: 2-[[(Z)-[5-hydroxy-4-[(E)-3-hydroxy-4-methyloct-1-en-6-ynyl]-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]methyl]thio]-N,N-dimethylacetamide IUPAC Name: 2-[(Z)-[5-hydroxy-4-[(E)-3-hydroxy-4-methyloct-1-en-6-ynyl]-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]methyl]sulfanyl-N,N-dimethylacetamide Traditional Name: 2-[[(Z)-[5-hydroxy-4-[(E)-3-hydroxy-4-methyl-oct-1-en-6-ynyl]-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]methyl]thio]-N,N-dimethyl-acetamide Formula: C22H33NO3S MolecularWeight: 391.56732

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC(C)C(C=CC1C(CC2C1CC(=CSCC(=O)N(C)C)C2)O)O

Isomeric SMILES

CC#CCC(C)C(/C=C/C1C(CC2C1C/C(=C\SCC(=O)N(C)C)/C2)O)O

InChI

InChI=1S/C22H33NO3S/c1-5-6-7-15(2)20(24)9-8-18-19-11-16(10-17(19)12-21(18)25)13-27-14-22(26)23(3)4/h8-9,13,15,17-21,24-25H,7,10-12,14H2,1-4H3/b9-8+,16-13-