N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-3-(methoxymethyl)benzamide

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-3-(methoxymethyl)benzamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-3-(methoxymethyl)benzamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-3-(methoxymethyl)benzamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-3-(methoxymethyl)benzamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-3-(methoxymethyl)benzamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC=CC(=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

Isomeric SMILES

COCC1=CC=CC(=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

InChI

InChI=1S/C25H33N3O5S/c1-32-19-20-7-6-8-21(17-20)25(29)26-23-18-22(34(30,31)28-13-15-33-16-14-28)9-10-24(23)27-11-4-2-3-5-12-27/h6-10,17-18H,2-5,11-16,19H2,1H3,(H,26,29)