5-[[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]methylene]-3-ethyl-2-thioxo-thiazolidin-4-one CAS Name: 5-[[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-3-pyrrolyl]methylidene]-3-ethyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[1-[4-(1-adamantyl)phenyl]-2,5-dimethylpyrrol-3-yl]methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-[[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]methylene]-3-ethyl-2-thioxo-thiazolidin-4-one Formula: C28H32N2OS2 MolecularWeight: 476.69648

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=C(N(C(=C2)C)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5)C)SC1=S

Isomeric SMILES

CCN1C(=O)C(=CC2=C(N(C(=C2)C)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5)C)SC1=S

InChI

InChI=1S/C28H32N2OS2/c1-4-29-26(31)25(33-27(29)32)13-22-9-17(2)30(18(22)3)24-7-5-23(6-8-24)28-14-19-10-20(15-28)12-21(11-19)16-28/h5-9,13,19-21H,4,10-12,14-16H2,1-3H3