N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C23H27N3O3S2/c1-17(23-24-20-7-3-4-8-21(20)30-23)25(2)22(27)14-11-18-9-12-19(13-10-18)31(28,29)26-15-5-6-16-26/h3-4,7-10,12-13,17H,5-6,11,14-16H2,1-2H3