(5Z)-3-hexyl-5-[[1-phenyl-3-(4-piperidin-1-ylsulfonylphenyl)pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5Z)-3-hexyl-5-[[1-phenyl-3-(4-piperidin-1-ylsulfonylphenyl)pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5Z)-3-hexyl-5-[[1-phenyl-3-[4-(1-piperidylsulfonyl)phenyl]pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-4-one CAS Name: (5Z)-3-hexyl-5-[[1-phenyl-3-[4-(1-piperidinylsulfonyl)phenyl]-4-pyrazolyl]methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5Z)-3-hexyl-5-[[1-phenyl-3-(4-piperidin-1-ylsulfonylphenyl)pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5Z)-3-hexyl-5-[[1-phenyl-3-(4-piperidinosulfonylphenyl)pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-4-one Formula: C30H34N4O3S3 MolecularWeight: 594.81096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C5=CC=CC=C5)SC1=S

Isomeric SMILES

CCCCCCN1C(=O)/C(=C/C2=CN(N=C2C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C5=CC=CC=C5)/SC1=S

InChI

InChI=1S/C30H34N4O3S3/c1-2-3-4-11-20-33-29(35)27(39-30(33)38)21-24-22-34(25-12-7-5-8-13-25)31-28(24)23-14-16-26(17-15-23)40(36,37)32-18-9-6-10-19-32/h5,7-8,12-17,21-22H,2-4,6,9-11,18-20H2,1H3/b27-21-