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

Systemtic Name: 3-[(4-methylphenyl)methyl]-N-phenyl-4-(3-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-imine Openeye Name: N-phenyl-3-(p-tolylmethyl)-4-(3-pyrrolidin-1-ylsulfonylphenyl)thiazol-2-imine CAS Name: 3-[(4-methylphenyl)methyl]-N-phenyl-4-[3-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolimine IUPAC Name: 3-[(4-methylphenyl)methyl]-N-phenyl-4-(3-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-imine Traditional Name: [3-(4-methylbenzyl)-4-(3-pyrrolidinosulfonylphenyl)-4-thiazolin-2-ylidene]-phenyl-amine Formula: C27H27N3O2S2 MolecularWeight: 489.65218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=CSC2=NC3=CC=CC=C3)C4=CC(=CC=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=CSC2=NC3=CC=CC=C3)C4=CC(=CC=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C27H27N3O2S2/c1-21-12-14-22(15-13-21)19-30-26(20-33-27(30)28-24-9-3-2-4-10-24)23-8-7-11-25(18-23)34(31,32)29-16-5-6-17-29/h2-4,7-15,18,20H,5-6,16-17,19H2,1H3