(17'Z)-17'-[isocyano-(4-methylphenyl)sulfonyl-methylidene]-10',13'-dimethyl-spiro[1,2-dithiolane-3,3'-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]

Systemtic Name: (17'Z)-17'-[isocyano-(4-methylphenyl)sulfonyl-methylidene]-10',13'-dimethyl-spiro[1,2-dithiolane-3,3'-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene] Openeye Name: (17Z)-17-[isocyano(p-tolylsulfonyl)methylene]-10,13-dimethyl-spiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,3'-dithiolane] CAS Name: (17Z)-17-[isocyano-(4-methylphenyl)sulfonylmethylidene]-10,13-dimethylspiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,3'-dithiolane] IUPAC Name: (17Z)-17-[isocyano-(4-methylphenyl)sulfonylmethylidene]-10,13-dimethylspiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,3'-dithiolane] Traditional Name: (17Z)-17-[isocyano(tosyl)methylene]-10,13-dimethyl-spiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,3'-dithiolane] Formula: C30H37NO2S3 MolecularWeight: 539.81528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=C2CCC3C2(CCC4C3CCC5=CC6(CCC45C)CCSS6)C)[N+]#[C-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C\2/CCC3C2(CCC4C3CCC5=CC6(CCC45C)CCSS6)C)/[N+]#[C-]

InChI

InChI=1S/C30H37NO2S3/c1-20-5-8-22(9-6-20)36(32,33)27(31-4)26-12-11-24-23-10-7-21-19-30(17-18-34-35-30)16-15-28(21,2)25(23)13-14-29(24,26)3/h5-6,8-9,19,23-25H,7,10-18H2,1-3H3/b27-26-