N-[2-[(2-azanyl-5-chloranyl-phenyl)-cyclohexyl-methyl]sulfanylethyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[2-[(2-azanyl-5-chloranyl-phenyl)-cyclohexyl-methyl]sulfanylethyl]-3,4-dimethoxy-benzamide Openeye Name: N-[2-[(2-amino-5-chloro-phenyl)-cyclohexyl-methyl]sulfanylethyl]-3,4-dimethoxy-benzamide CAS Name: N-[2-[[(2-amino-5-chlorophenyl)-cyclohexylmethyl]thio]ethyl]-3,4-dimethoxybenzamide IUPAC Name: N-[2-[(2-amino-5-chlorophenyl)-cyclohexylmethyl]sulfanylethyl]-3,4-dimethoxybenzamide Traditional Name: N-[2-[[(2-amino-5-chloro-phenyl)-cyclohexyl-methyl]thio]ethyl]-3,4-dimethoxy-benzamide Formula: C24H31ClN2O3S MolecularWeight: 463.03254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCCSC(C2CCCCC2)C3=C(C=CC(=C3)Cl)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCCSC(C2CCCCC2)C3=C(C=CC(=C3)Cl)N)OC

InChI

InChI=1S/C24H31ClN2O3S/c1-29-21-11-8-17(14-22(21)30-2)24(28)27-12-13-31-23(16-6-4-3-5-7-16)19-15-18(25)9-10-20(19)26/h8-11,14-16,23H,3-7,12-13,26H2,1-2H3,(H,27,28)