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

Systemtic Name: N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-(phenylmethyl)sulfonyl-ethanamide Openeye Name: N-benzyl-2-benzylsulfonyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-(phenylmethyl)sulfonylacetamide IUPAC Name: N-benzyl-2-benzylsulfonyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)acetamide Traditional Name: N-benzyl-2-benzylsulfonyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)acetamide Formula: C24H21ClN2O4S2 MolecularWeight: 501.01754

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)CS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C24H21ClN2O4S2/c1-31-20-13-12-19(25)23-22(20)26-24(32-23)27(14-17-8-4-2-5-9-17)21(28)16-33(29,30)15-18-10-6-3-7-11-18/h2-13H,14-16H2,1H3