N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-4-ethylsulfonyl-N-(phenylmethyl)benzamide

Systemtic Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-4-ethylsulfonyl-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-4-ethylsulfonyl-benzamide CAS Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-4-ethylsulfonyl-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-4-ethylsulfonylbenzamide Traditional Name: N-benzyl-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-4-esyl-benzamide Formula: C25H24N2O5S2 MolecularWeight: 496.59846

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C3=NC4=C(C=CC(=C4S3)OC)OC

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C3=NC4=C(C=CC(=C4S3)OC)OC

InChI

InChI=1S/C25H24N2O5S2/c1-4-34(29,30)19-12-10-18(11-13-19)24(28)27(16-17-8-6-5-7-9-17)25-26-22-20(31-2)14-15-21(32-3)23(22)33-25/h5-15H,4,16H2,1-3H3