3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(3,4-dihydro-2H-chromen-4-yl)propanamide

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(3,4-dihydro-2H-chromen-4-yl)propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-chroman-4-yl-propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-(3,4-dihydro-2H-1-benzopyran-4-yl)propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(3,4-dihydro-2H-chromen-4-yl)propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-chroman-4-yl-propionamide Formula: C24H30N2O4S MolecularWeight: 442.571

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3CCOC4=CC=CC=C34

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3CCOC4=CC=CC=C34

InChI

InChI=1S/C24H30N2O4S/c27-24(25-22-15-18-30-23-8-4-3-7-21(22)23)14-11-19-9-12-20(13-10-19)31(28,29)26-16-5-1-2-6-17-26/h3-4,7-10,12-13,22H,1-2,5-6,11,14-18H2,(H,25,27)