N-[2-[4-(4-cyanophenyl)sulfonylpiperazin-1-yl]ethanoyl]-4-methoxy-benzamide

Systemtic Name: N-[2-[4-(4-cyanophenyl)sulfonylpiperazin-1-yl]ethanoyl]-4-methoxy-benzamide Openeye Name: N-[2-[4-(4-cyanophenyl)sulfonylpiperazin-1-yl]acetyl]-4-methoxy-benzamide CAS Name: N-[2-[4-(4-cyanophenyl)sulfonyl-1-piperazinyl]-1-oxoethyl]-4-methoxybenzamide IUPAC Name: N-[2-[4-(4-cyanophenyl)sulfonylpiperazin-1-yl]acetyl]-4-methoxybenzamide Traditional Name: N-[2-[4-(4-cyanophenyl)sulfonylpiperazino]acetyl]-4-methoxy-benzamide Formula: C21H22N4O5S MolecularWeight: 442.48818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H22N4O5S/c1-30-18-6-4-17(5-7-18)21(27)23-20(26)15-24-10-12-25(13-11-24)31(28,29)19-8-2-16(14-22)3-9-19/h2-9H,10-13,15H2,1H3,(H,23,26,27)