N-(1,3-benzothiazol-2-yl)-2-[3-(phenylmethyl)sulfonylindol-1-yl]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[3-(phenylmethyl)sulfonylindol-1-yl]ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(3-benzylsulfonylindol-1-yl)acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[3-(phenylmethyl)sulfonyl-1-indolyl]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(3-benzylsulfonylindol-1-yl)acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(3-benzylsulfonylindol-1-yl)acetamide Formula: C24H19N3O3S2 MolecularWeight: 461.55596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H19N3O3S2/c28-23(26-24-25-19-11-5-7-13-21(19)31-24)15-27-14-22(18-10-4-6-12-20(18)27)32(29,30)16-17-8-2-1-3-9-17/h1-14H,15-16H2,(H,25,26,28)