N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3,4-dihydro-2H-quinolin-1-yl)ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3,4-dihydro-2H-quinolin-1-yl)ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3,4-dihydro-2H-quinolin-1-yl)acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-(3,4-dihydro-2H-quinolin-1-yl)acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-(3,4-dihydro-2H-quinolin-1-yl)acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3,4-dihydro-2H-quinolin-1-yl)acetamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CN3CCCC4=CC=CC=C43

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CN3CCCC4=CC=CC=C43

InChI

InChI=1S/C24H31N3O4S/c1-31-23-13-12-20(32(29,30)27-15-6-2-3-7-16-27)17-21(23)25-24(28)18-26-14-8-10-19-9-4-5-11-22(19)26/h4-5,9,11-13,17H,2-3,6-8,10,14-16,18H2,1H3,(H,25,28)