4-[[4-(azepan-1-ylsulfonyl)phenyl]carbonylamino]-N-(2-diethylaminoethyl)benzamide

Systemtic Name: 4-[[4-(azepan-1-ylsulfonyl)phenyl]carbonylamino]-N-(2-diethylaminoethyl)benzamide Openeye Name: 4-[[4-(azepan-1-ylsulfonyl)benzoyl]amino]-N-(2-diethylaminoethyl)benzamide CAS Name: 4-[[[4-(1-azepanylsulfonyl)phenyl]-oxomethyl]amino]-N-(2-diethylaminoethyl)benzamide IUPAC Name: 4-[[4-(azepan-1-ylsulfonyl)benzoyl]amino]-N-(2-diethylaminoethyl)benzamide Traditional Name: 4-[[4-(azepan-1-ylsulfonyl)benzoyl]amino]-N-(2-diethylaminoethyl)benzamide Formula: C26H36N4O4S MolecularWeight: 500.65344

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C26H36N4O4S/c1-3-29(4-2)20-17-27-25(31)21-9-13-23(14-10-21)28-26(32)22-11-15-24(16-12-22)35(33,34)30-18-7-5-6-8-19-30/h9-16H,3-8,17-20H2,1-2H3,(H,27,31)(H,28,32)