2-[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-yl]-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: 2-[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-yl]-N-(4-sulfamoylphenyl)propanamide Openeye Name: 2-[4-[2-(dimethylamino)-2-oxo-ethyl]-1,4-diazepan-1-yl]-N-(4-sulfamoylphenyl)propanamide CAS Name: 2-[4-[2-(dimethylamino)-2-oxoethyl]-1,4-diazepan-1-yl]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: 2-[4-[2-(dimethylamino)-2-oxoethyl]-1,4-diazepan-1-yl]-N-(4-sulfamoylphenyl)propanamide Traditional Name: 2-[4-[2-(dimethylamino)-2-keto-ethyl]-1,4-diazepan-1-yl]-N-(4-sulfamoylphenyl)propionamide Formula: C18H29N5O4S MolecularWeight: 411.51896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)N2CCCN(CC2)CC(=O)N(C)C

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)N2CCCN(CC2)CC(=O)N(C)C

InChI

InChI=1S/C18H29N5O4S/c1-14(18(25)20-15-5-7-16(8-6-15)28(19,26)27)23-10-4-9-22(11-12-23)13-17(24)21(2)3/h5-8,14H,4,9-13H2,1-3H3,(H,20,25)(H2,19,26,27)