2-(4-methoxyphenyl)-N-[6-[4-(phenylsulfonyl)-1,4-diazepan-1-yl]pyridin-3-yl]ethanamide

Systemtic Name: 2-(4-methoxyphenyl)-N-[6-[4-(phenylsulfonyl)-1,4-diazepan-1-yl]pyridin-3-yl]ethanamide Openeye Name: N-[6-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-3-pyridyl]-2-(4-methoxyphenyl)acetamide CAS Name: N-[6-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide IUPAC Name: N-[6-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]pyridin-3-yl]-2-(4-methoxyphenyl)acetamide Traditional Name: N-[6-(4-besyl-1,4-diazepan-1-yl)-3-pyridyl]-2-(4-methoxyphenyl)acetamide Formula: C25H28N4O4S MolecularWeight: 480.57922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC2=CN=C(C=C2)N3CCCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC2=CN=C(C=C2)N3CCCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O4S/c1-33-22-11-8-20(9-12-22)18-25(30)27-21-10-13-24(26-19-21)28-14-5-15-29(17-16-28)34(31,32)23-6-3-2-4-7-23/h2-4,6-13,19H,5,14-18H2,1H3,(H,27,30)