N-[(5Z)-5-[[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]adamantane-1-carboxamide

Systemtic Name: N-[(5Z)-5-[[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]adamantane-1-carboxamide Openeye Name: N-[(5Z)-5-[[3-nitro-4-(p-tolylsulfanyl)phenyl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]adamantane-1-carboxamide CAS Name: N-[(5Z)-5-[[4-[(4-methylphenyl)thio]-3-nitrophenyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-1-adamantanecarboxamide IUPAC Name: N-[(5Z)-5-[[4-(4-methylphenyl)sulfanyl-3-nitrophenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]adamantane-1-carboxamide Traditional Name: N-[(5Z)-4-keto-5-[3-nitro-4-(p-tolylthio)benzylidene]-2-thioxo-thiazolidin-3-yl]adamantane-1-carboxamide Formula: C28H27N3O4S3 MolecularWeight: 565.72668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)NC(=O)C45CC6CC(C4)CC(C6)C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)/C=C\3/C(=O)N(C(=S)S3)NC(=O)C45CC6CC(C4)CC(C6)C5)[N+](=O)[O-]

InChI

InChI=1S/C28H27N3O4S3/c1-16-2-5-21(6-3-16)37-23-7-4-17(11-22(23)31(34)35)12-24-25(32)30(27(36)38-24)29-26(33)28-13-18-8-19(14-28)10-20(9-18)15-28/h2-7,11-12,18-20H,8-10,13-15H2,1H3,(H,29,33)/b24-12-