2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-morpholinosulfonylphenyl)methyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(4-morpholinosulfonylbenzyl)acetamide Formula: C20H21N3O4S3 MolecularWeight: 463.59344

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H21N3O4S3/c24-19(14-28-20-22-17-3-1-2-4-18(17)29-20)21-13-15-5-7-16(8-6-15)30(25,26)23-9-11-27-12-10-23/h1-8H,9-14H2,(H,21,24)