N-[2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]cyclohexanecarboxamide

Systemtic Name: N-[2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]cyclohexanecarboxamide Openeye Name: N-[2-(p-tolylsulfonylamino)-1,3-benzothiazol-6-yl]cyclohexanecarboxamide CAS Name: N-[2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]cyclohexanecarboxamide IUPAC Name: N-[2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]cyclohexanecarboxamide Traditional Name: N-[2-(tosylamino)-1,3-benzothiazol-6-yl]cyclohexanecarboxamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)NC(=O)C4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)NC(=O)C4CCCCC4

InChI

InChI=1S/C21H23N3O3S2/c1-14-7-10-17(11-8-14)29(26,27)24-21-23-18-12-9-16(13-19(18)28-21)22-20(25)15-5-3-2-4-6-15/h7-13,15H,2-6H2,1H3,(H,22,25)(H,23,24)