3-(azepan-1-ylsulfonyl)-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[4-(morpholinomethyl)phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[4-(4-morpholinylmethyl)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[4-(morpholinomethyl)phenyl]benzamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)CN4CCOCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)CN4CCOCC4

InChI

InChI=1S/C24H31N3O4S/c28-24(25-22-10-8-20(9-11-22)19-26-14-16-31-17-15-26)21-6-5-7-23(18-21)32(29,30)27-12-3-1-2-4-13-27/h5-11,18H,1-4,12-17,19H2,(H,25,28)