3-[2-(3,4-dimethoxyphenyl)ethyl]-N-phenyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-imine

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-N-phenyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-imine Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-N-phenyl-4-[4-(1-piperidylsulfonyl)phenyl]thiazol-2-imine CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-N-phenyl-4-[4-(1-piperidinylsulfonyl)phenyl]-2-thiazolimine IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-N-phenyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-imine Traditional Name: [3-homoveratryl-4-(4-piperidinosulfonylphenyl)-4-thiazolin-2-ylidene]-phenyl-amine Formula: C30H33N3O4S2 MolecularWeight: 563.73072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=CSC2=NC3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=CSC2=NC3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5)OC

InChI

InChI=1S/C30H33N3O4S2/c1-36-28-16-11-23(21-29(28)37-2)17-20-33-27(22-38-30(33)31-25-9-5-3-6-10-25)24-12-14-26(15-13-24)39(34,35)32-18-7-4-8-19-32/h3,5-6,9-16,21-22H,4,7-8,17-20H2,1-2H3