N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-3-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H25N3O3S2/c1-24(16-21-23-19-6-2-3-7-20(19)29-21)22(26)13-10-17-8-11-18(12-9-17)30(27,28)25-14-4-5-15-25/h2-3,6-9,11-12H,4-5,10,13-16H2,1H3