N-[2-[(2-azanyl-5-chloranyl-phenyl)-cyclohexyl-methyl]sulfanylethyl]-4-sulfamoyl-benzamide

Systemtic Name: N-[2-[(2-azanyl-5-chloranyl-phenyl)-cyclohexyl-methyl]sulfanylethyl]-4-sulfamoyl-benzamide Openeye Name: N-[2-[(2-amino-5-chloro-phenyl)-cyclohexyl-methyl]sulfanylethyl]-4-sulfamoyl-benzamide CAS Name: N-[2-[[(2-amino-5-chlorophenyl)-cyclohexylmethyl]thio]ethyl]-4-sulfamoylbenzamide IUPAC Name: N-[2-[(2-amino-5-chlorophenyl)-cyclohexylmethyl]sulfanylethyl]-4-sulfamoylbenzamide Traditional Name: N-[2-[[(2-amino-5-chloro-phenyl)-cyclohexyl-methyl]thio]ethyl]-4-sulfamoyl-benzamide Formula: C22H28ClN3O3S2 MolecularWeight: 482.05902

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2=C(C=CC(=C2)Cl)N)SCCNC(=O)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1CCC(CC1)C(C2=C(C=CC(=C2)Cl)N)SCCNC(=O)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C22H28ClN3O3S2/c23-17-8-11-20(24)19(14-17)21(15-4-2-1-3-5-15)30-13-12-26-22(27)16-6-9-18(10-7-16)31(25,28)29/h6-11,14-15,21H,1-5,12-13,24H2,(H,26,27)(H2,25,28,29)