N-[3-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide

Systemtic Name: N-[3-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide Openeye Name: N-[3-(2-amino-2-oxo-ethoxy)phenyl]-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide CAS Name: N-[3-(2-amino-2-oxoethoxy)phenyl]-3-[4-(1-azepanylsulfonyl)phenyl]propanamide IUPAC Name: N-[3-(2-amino-2-oxoethoxy)phenyl]-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide Traditional Name: N-[3-(2-amino-2-keto-ethoxy)phenyl]-3-[4-(azepan-1-ylsulfonyl)phenyl]propionamide Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC(=CC=C3)OCC(=O)N

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC(=CC=C3)OCC(=O)N

InChI

InChI=1S/C23H29N3O5S/c24-22(27)17-31-20-7-5-6-19(16-20)25-23(28)13-10-18-8-11-21(12-9-18)32(29,30)26-14-3-1-2-4-15-26/h5-9,11-12,16H,1-4,10,13-15,17H2,(H2,24,27)(H,25,28)