2-(azepan-1-yl)-N-[4-[(5-nitro-1,3-thiazol-2-yl)sulfamoyl]phenyl]ethanamide

Systemtic Name: 2-(azepan-1-yl)-N-[4-[(5-nitro-1,3-thiazol-2-yl)sulfamoyl]phenyl]ethanamide Openeye Name: 2-(azepan-1-yl)-N-[4-[(5-nitrothiazol-2-yl)sulfamoyl]phenyl]acetamide CAS Name: 2-(1-azepanyl)-N-[4-[(5-nitro-2-thiazolyl)sulfamoyl]phenyl]acetamide IUPAC Name: 2-(azepan-1-yl)-N-[4-[(5-nitro-1,3-thiazol-2-yl)sulfamoyl]phenyl]acetamide Traditional Name: 2-(azepan-1-yl)-N-[4-[(5-nitrothiazol-2-yl)sulfamoyl]phenyl]acetamide Formula: C17H21N5O5S2 MolecularWeight: 439.50914

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O5S2/c23-15(12-21-9-3-1-2-4-10-21)19-13-5-7-14(8-6-13)29(26,27)20-17-18-11-16(28-17)22(24)25/h5-8,11H,1-4,9-10,12H2,(H,18,20)(H,19,23)