3-[(4-chlorophenyl)methyl]-N-(4-ethoxyphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-imine

Systemtic Name: 3-[(4-chlorophenyl)methyl]-N-(4-ethoxyphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-imine Openeye Name: 3-[(4-chlorophenyl)methyl]-N-(4-ethoxyphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-2-imine CAS Name: 3-[(4-chlorophenyl)methyl]-N-(4-ethoxyphenyl)-4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolimine IUPAC Name: 3-[(4-chlorophenyl)methyl]-N-(4-ethoxyphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-imine Traditional Name: [3-(4-chlorobenzyl)-4-(4-pyrrolidinosulfonylphenyl)-4-thiazolin-2-ylidene]-p-phenetyl-amine Formula: C28H28ClN3O3S2 MolecularWeight: 554.12322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)CC5=CC=C(C=C5)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)CC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H28ClN3O3S2/c1-2-35-25-13-11-24(12-14-25)30-28-32(19-21-5-9-23(29)10-6-21)27(20-36-28)22-7-15-26(16-8-22)37(33,34)31-17-3-4-18-31/h5-16,20H,2-4,17-19H2,1H3