9-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrothiochromen-4-yl]nonylcyanamide

Systemtic Name: 9-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrothiochromen-4-yl]nonylcyanamide Openeye Name: 9-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-thiochroman-4-yl]nonylcyanamide CAS Name: 9-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydro-1-benzothiopyran-4-yl]nonylcyanamide IUPAC Name: 9-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydrothiochromen-4-yl]nonylcyanamide Traditional Name: 9-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-thiochroman-4-yl]nonylcyanamide Formula: C26H34N2O2S MolecularWeight: 438.62536

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC2=C(C1CCCCCCCCCNC#N)C=CC(=C2)O)C3=CC=C(C=C3)O

Isomeric SMILES

CC1(CSC2=C(C1CCCCCCCCCNC#N)C=CC(=C2)O)C3=CC=C(C=C3)O

InChI

InChI=1S/C26H34N2O2S/c1-26(20-10-12-21(29)13-11-20)18-31-25-17-22(30)14-15-23(25)24(26)9-7-5-3-2-4-6-8-16-28-19-27/h10-15,17,24,28-30H,2-9,16,18H2,1H3