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

Systemtic Name: 2-[4-(4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]-N-(4-phenylmethoxyphenyl)ethanamide Openeye Name: N-(4-benzyloxyphenyl)-2-[4-(4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]acetamide CAS Name: 2-[4-(4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]-N-(4-phenylmethoxyphenyl)acetamide IUPAC Name: 2-[4-(4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]-N-(4-phenylmethoxyphenyl)acetamide Traditional Name: N-(4-benzoxyphenyl)-2-[4-(4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]acetamide Formula: C27H31N3O5S MolecularWeight: 509.61714

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)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O5S/c1-34-24-12-14-26(15-13-24)36(32,33)30-17-5-16-29(18-19-30)20-27(31)28-23-8-10-25(11-9-23)35-21-22-6-3-2-4-7-22/h2-4,6-15H,5,16-21H2,1H3,(H,28,31)