N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: N-benzyl-3-benzylsulfonyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: N-benzyl-3-benzylsulfonyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: N-benzyl-3-benzylsulfonyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)propionamide Formula: C25H23ClN2O4S2 MolecularWeight: 515.04412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CC=C3)C(=O)CCS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

COC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CC=C3)C(=O)CCS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H23ClN2O4S2/c1-32-21-13-12-20(26)24-23(21)27-25(33-24)28(16-18-8-4-2-5-9-18)22(29)14-15-34(30,31)17-19-10-6-3-7-11-19/h2-13H,14-17H2,1H3