N-(1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-benzylsulfonyl-N-(2-furylmethyl)propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-benzylsulfonyl-N-(furan-2-ylmethyl)propanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-benzylsulfonyl-N-(2-furfuryl)propionamide Formula: C22H20N2O4S2 MolecularWeight: 440.5352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CCC(=O)N(CC2=CC=CO2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CCC(=O)N(CC2=CC=CO2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H20N2O4S2/c25-21(12-14-30(26,27)16-17-7-2-1-3-8-17)24(15-18-9-6-13-28-18)22-23-19-10-4-5-11-20(19)29-22/h1-11,13H,12,14-16H2