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

Systemtic Name: 5-[[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]methylidene]-3-cyclohexyl-2-cyclohexylimino-1,3-thiazolidin-4-one Openeye Name: 5-[[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]methylene]-3-cyclohexyl-2-cyclohexylimino-thiazolidin-4-one CAS Name: 5-[[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-3-pyrrolyl]methylidene]-3-cyclohexyl-2-cyclohexylimino-4-thiazolidinone IUPAC Name: 5-[[1-[4-(1-adamantyl)phenyl]-2,5-dimethylpyrrol-3-yl]methylidene]-3-cyclohexyl-2-cyclohexylimino-1,3-thiazolidin-4-one Traditional Name: 5-[[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]methylene]-3-cyclohexyl-2-cyclohexylimino-thiazolidin-4-one Formula: C38H49N3OS MolecularWeight: 595.88016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)C)C=C6C(=O)N(C(=NC7CCCCC7)S6)C8CCCCC8

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)C)C=C6C(=O)N(C(=NC7CCCCC7)S6)C8CCCCC8

InChI

InChI=1S/C38H49N3OS/c1-25-17-30(21-35-36(42)41(33-11-7-4-8-12-33)37(43-35)39-32-9-5-3-6-10-32)26(2)40(25)34-15-13-31(14-16-34)38-22-27-18-28(23-38)20-29(19-27)24-38/h13-17,21,27-29,32-33H,3-12,18-20,22-24H2,1-2H3