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

Systemtic Name: N-[2-[(2-azanyl-5-chloranyl-phenyl)-cyclohexyl-methyl]sulfanylethyl]-4-methylsulfonyl-benzamide Openeye Name: N-[2-[(2-amino-5-chloro-phenyl)-cyclohexyl-methyl]sulfanylethyl]-4-methylsulfonyl-benzamide CAS Name: N-[2-[[(2-amino-5-chlorophenyl)-cyclohexylmethyl]thio]ethyl]-4-methylsulfonylbenzamide IUPAC Name: N-[2-[(2-amino-5-chlorophenyl)-cyclohexylmethyl]sulfanylethyl]-4-methylsulfonylbenzamide Traditional Name: N-[2-[[(2-amino-5-chloro-phenyl)-cyclohexyl-methyl]thio]ethyl]-4-mesyl-benzamide Formula: C23H29ClN2O3S2 MolecularWeight: 481.07096

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NCCSC(C2CCCCC2)C3=C(C=CC(=C3)Cl)N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NCCSC(C2CCCCC2)C3=C(C=CC(=C3)Cl)N

InChI

InChI=1S/C23H29ClN2O3S2/c1-31(28,29)19-10-7-17(8-11-19)23(27)26-13-14-30-22(16-5-3-2-4-6-16)20-15-18(24)9-12-21(20)25/h7-12,15-16,22H,2-6,13-14,25H2,1H3,(H,26,27)