3-(azepan-1-ylsulfonyl)-N-(4-butylphenyl)-4-methoxy-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(4-butylphenyl)-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(4-butylphenyl)-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(4-butylphenyl)-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(4-butylphenyl)-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(4-butylphenyl)-4-methoxy-benzamide Formula: C24H32N2O4S MolecularWeight: 444.58688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C24H32N2O4S/c1-3-4-9-19-10-13-21(14-11-19)25-24(27)20-12-15-22(30-2)23(18-20)31(28,29)26-16-7-5-6-8-17-26/h10-15,18H,3-9,16-17H2,1-2H3,(H,25,27)