N-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethanoyl]-4-methoxy-benzamide

Systemtic Name: N-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethanoyl]-4-methoxy-benzamide Openeye Name: N-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]acetyl]-4-methoxy-benzamide CAS Name: N-[2-[4-(1-azepanylsulfonyl)-1-piperazinyl]-1-oxoethyl]-4-methoxybenzamide IUPAC Name: N-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]acetyl]-4-methoxybenzamide Traditional Name: N-[2-[4-(azepan-1-ylsulfonyl)piperazino]acetyl]-4-methoxy-benzamide Formula: C20H30N4O5S MolecularWeight: 438.541

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)N3CCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=O)CN2CCN(CC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H30N4O5S/c1-29-18-8-6-17(7-9-18)20(26)21-19(25)16-22-12-14-24(15-13-22)30(27,28)23-10-4-2-3-5-11-23/h6-9H,2-5,10-16H2,1H3,(H,21,25,26)