1-(4-methylphenyl)sulfonyl-N-[4-[4-(phenylmethyl)phenyl]-1,3-thiazol-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-[4-[4-(phenylmethyl)phenyl]-1,3-thiazol-2-yl]pyrrolidine-2-carboxamide Openeye Name: N-[4-(4-benzylphenyl)thiazol-2-yl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[4-[4-(phenylmethyl)phenyl]-2-thiazolyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[4-(4-benzylphenyl)-1,3-thiazol-2-yl]-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-[4-(4-benzylphenyl)thiazol-2-yl]-1-tosyl-pyrrolidine-2-carboxamide Formula: C28H27N3O3S2 MolecularWeight: 517.66228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)CC5=CC=CC=C5

InChI

InChI=1S/C28H27N3O3S2/c1-20-9-15-24(16-10-20)36(33,34)31-17-5-8-26(31)27(32)30-28-29-25(19-35-28)23-13-11-22(12-14-23)18-21-6-3-2-4-7-21/h2-4,6-7,9-16,19,26H,5,8,17-18H2,1H3,(H,29,30,32)