N-(1,3-benzothiazol-2-yl)-2-[cyclohexyl-(4-methylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[cyclohexyl-(4-methylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[cyclohexyl(p-tolylsulfonyl)amino]acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[cyclohexyl-(4-methylphenyl)sulfonylamino]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[cyclohexyl-(4-methylphenyl)sulfonylamino]acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[cyclohexyl(tosyl)amino]acetamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=NC3=CC=CC=C3S2)C4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=NC3=CC=CC=C3S2)C4CCCCC4

InChI

InChI=1S/C22H25N3O3S2/c1-16-11-13-18(14-12-16)30(27,28)25(17-7-3-2-4-8-17)15-21(26)24-22-23-19-9-5-6-10-20(19)29-22/h5-6,9-14,17H,2-4,7-8,15H2,1H3,(H,23,24,26)