4-(azepan-1-ylsulfonyl)-N-[2-(thiophen-2-ylsulfonylamino)phenyl]benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[2-(thiophen-2-ylsulfonylamino)phenyl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[2-(2-thienylsulfonylamino)phenyl]benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[2-(thiophen-2-ylsulfonylamino)phenyl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[2-(thiophen-2-ylsulfonylamino)phenyl]benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-[2-(2-thienylsulfonylamino)phenyl]benzamide Formula: C23H25N3O5S3 MolecularWeight: 519.6567

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C23H25N3O5S3/c27-23(18-11-13-19(14-12-18)34(30,31)26-15-5-1-2-6-16-26)24-20-8-3-4-9-21(20)25-33(28,29)22-10-7-17-32-22/h3-4,7-14,17,25H,1-2,5-6,15-16H2,(H,24,27)