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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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