2-[2-(4-cyclohexylpiperazin-1-yl)-2-oxidanylidene-ethyl]sulfinyl-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-[2-(4-cyclohexylpiperazin-1-yl)-2-oxidanylidene-ethyl]sulfinyl-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[2-(4-cyclohexylpiperazin-1-yl)-2-oxo-ethyl]sulfinyl-N-(4-methoxyphenyl)acetamide CAS Name: 2-[2-(4-cyclohexyl-1-piperazinyl)-2-oxoethyl]sulfinyl-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]sulfinyl-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[2-(4-cyclohexylpiperazino)-2-keto-ethyl]sulfinyl-N-(4-methoxyphenyl)acetamide Formula: C21H31N3O4S MolecularWeight: 421.55354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CS(=O)CC(=O)N2CCN(CC2)C3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CS(=O)CC(=O)N2CCN(CC2)C3CCCCC3

InChI

InChI=1S/C21H31N3O4S/c1-28-19-9-7-17(8-10-19)22-20(25)15-29(27)16-21(26)24-13-11-23(12-14-24)18-5-3-2-4-6-18/h7-10,18H,2-6,11-16H2,1H3,(H,22,25)