N-(3,4-dimethoxyphenyl)-2-[4-(4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-[4-(4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[4-(4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[4-(4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-[4-(4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]acetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[4-(4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]acetamide Formula: C22H29N3O6S MolecularWeight: 463.54716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC(=O)NC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC(=O)NC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H29N3O6S/c1-29-18-6-8-19(9-7-18)32(27,28)25-12-4-11-24(13-14-25)16-22(26)23-17-5-10-20(30-2)21(15-17)31-3/h5-10,15H,4,11-14,16H2,1-3H3,(H,23,26)