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

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(1,3-dithian-2-yl)benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(1,3-dithian-2-yl)benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-(1,3-dithian-2-yl)benzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(1,3-dithian-2-yl)benzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(1,3-dithian-2-yl)benzamide Formula: C23H28N2O3S3 MolecularWeight: 476.67502

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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)C4SCCCS4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C4SCCCS4

InChI

InChI=1S/C23H28N2O3S3/c26-22(18-6-8-19(9-7-18)23-29-16-5-17-30-23)24-20-10-12-21(13-11-20)31(27,28)25-14-3-1-2-4-15-25/h6-13,23H,1-5,14-17H2,(H,24,26)