(3S)-N-[4-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]-5-oxidanylidene-1-(phenylmethyl)-N-prop-2-enyl-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-[4-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]-5-oxidanylidene-1-(phenylmethyl)-N-prop-2-enyl-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-allyl-1-benzyl-N-[4-(4-methylsulfonylphenyl)thiazol-2-yl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-[4-(4-methylsulfonylphenyl)-2-thiazolyl]-5-oxo-1-(phenylmethyl)-N-prop-2-enyl-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-benzyl-N-[4-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]-5-oxo-N-prop-2-enylpyrrolidine-3-carboxamide Traditional Name: (3S)-N-allyl-1-benzyl-5-keto-N-[4-(4-mesylphenyl)thiazol-2-yl]pyrrolidine-3-carboxamide Formula: C25H25N3O4S2 MolecularWeight: 495.6137

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CSC(=N2)N(CC=C)C(=O)C3CC(=O)N(C3)CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CSC(=N2)N(CC=C)C(=O)[C@H]3CC(=O)N(C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O4S2/c1-3-13-28(24(30)20-14-23(29)27(16-20)15-18-7-5-4-6-8-18)25-26-22(17-33-25)19-9-11-21(12-10-19)34(2,31)32/h3-12,17,20H,1,13-16H2,2H3/t20-/m0/s1