N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(1,3-dithiolan-2-yl)benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(1,3-dithiolan-2-yl)benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(1,3-dithiolan-2-yl)benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-(1,3-dithiolan-2-yl)benzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(1,3-dithiolan-2-yl)benzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(1,3-dithiolan-2-yl)benzamide Formula: C22H26N2O3S3 MolecularWeight: 462.64844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C22H26N2O3S3/c25-21(17-5-7-18(8-6-17)22-28-15-16-29-22)23-19-9-11-20(12-10-19)30(26,27)24-13-3-1-2-4-14-24/h5-12,22H,1-4,13-16H2,(H,23,25)