N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-2-[[(2R)-oxolan-2-yl]methylsulfanyl]benzamide

Systemtic Name: N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-2-[[(2R)-oxolan-2-yl]methylsulfanyl]benzamide Openeye Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-2-[[(2R)-tetrahydrofuran-2-yl]methylsulfanyl]benzamide CAS Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene)-2-[[(2R)-2-oxolanyl]methylthio]benzamide IUPAC Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-2-[[(2R)-oxolan-2-yl]methylsulfanyl]benzamide Traditional Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-2-[[(2R)-tetrahydrofuran-2-yl]methylthio]benzamide Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(=NC(=O)C3=CC=CC=C3SCC4CCCO4)CC2OC(=C1)O

Isomeric SMILES

CC1=C2CCC(=NC(=O)C3=CC=CC=C3SC[C@H]4CCCO4)CC2OC(=C1)O

InChI

InChI=1S/C22H25NO4S/c1-14-11-21(24)27-19-12-15(8-9-17(14)19)23-22(25)18-6-2-3-7-20(18)28-13-16-5-4-10-26-16/h2-3,6-7,11,16,19,24H,4-5,8-10,12-13H2,1H3/t16-,19?/m1/s1