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

Systemtic Name: 7-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydrothiochromen-4-yl]heptanenitrile Openeye Name: 7-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-thiochroman-4-yl]heptanenitrile CAS Name: 7-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydro-1-benzothiopyran-4-yl]heptanenitrile IUPAC Name: 7-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydrothiochromen-4-yl]heptanenitrile Traditional Name: 7-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-thiochroman-4-yl]enanthonitrile Formula: C25H31NO2S MolecularWeight: 409.58414

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC2=C(C1CCCCCCC#N)C=CC(=C2)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1(CSC2=C(C1CCCCCCC#N)C=CC(=C2)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H31NO2S/c1-25(19-10-12-20(27-2)13-11-19)18-29-24-17-21(28-3)14-15-22(24)23(25)9-7-5-4-6-8-16-26/h10-15,17,23H,4-9,18H2,1-3H3