(2S)-1-(4-chlorophenyl)sulfonyl-N-(2-methyl-1,3-benzothiazol-6-yl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(4-chlorophenyl)sulfonyl-N-(2-methyl-1,3-benzothiazol-6-yl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(4-chlorophenyl)sulfonyl-N-(2-methyl-1,3-benzothiazol-6-yl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-(4-chlorophenyl)sulfonyl-N-(2-methyl-1,3-benzothiazol-6-yl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(4-chlorophenyl)sulfonyl-N-(2-methyl-1,3-benzothiazol-6-yl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-(4-chlorophenyl)sulfonyl-N-(2-methyl-1,3-benzothiazol-6-yl)pyrrolidine-2-carboxamide Formula: C19H18ClN3O3S2 MolecularWeight: 435.94752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)[C@@H]3CCCN3S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H18ClN3O3S2/c1-12-21-16-9-6-14(11-18(16)27-12)22-19(24)17-3-2-10-23(17)28(25,26)15-7-4-13(20)5-8-15/h4-9,11,17H,2-3,10H2,1H3,(H,22,24)/t17-/m0/s1