9-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydrothiochromen-4-yl]nonylcyanamide

Systemtic Name: 9-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydrothiochromen-4-yl]nonylcyanamide Openeye Name: 9-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-thiochroman-4-yl]nonylcyanamide CAS Name: 9-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydro-1-benzothiopyran-4-yl]nonylcyanamide IUPAC Name: 9-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydrothiochromen-4-yl]nonylcyanamide Traditional Name: 9-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-thiochroman-4-yl]nonylcyanamide Formula: C28H38N2O2S MolecularWeight: 466.67852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38N2O2S/c1-28(22-12-14-23(31-2)15-13-22)20-33-27-19-24(32-3)16-17-25(27)26(28)11-9-7-5-4-6-8-10-18-30-21-29/h12-17,19,26,30H,4-11,18,20H2,1-3H3