4-(1,3-dithian-2-yl)-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-benzohydrazide

Systemtic Name: 4-(1,3-dithian-2-yl)-N'-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-benzohydrazide Openeye Name: 4-(1,3-dithian-2-yl)-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)benzohydrazide CAS Name: 4-(1,3-dithian-2-yl)-N'-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]benzohydrazide IUPAC Name: 4-(1,3-dithian-2-yl)-N'-(4-pyrrolidin-1-ylsulfonylbenzoyl)benzohydrazide Traditional Name: 4-(1,3-dithian-2-yl)-N'-(4-pyrrolidinosulfonylbenzoyl)benzohydrazide Formula: C22H25N3O4S3 MolecularWeight: 491.6466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=C(C=C3)C4SCCCS4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=C(C=C3)C4SCCCS4

InChI

InChI=1S/C22H25N3O4S3/c26-20(16-4-6-18(7-5-16)22-30-14-3-15-31-22)23-24-21(27)17-8-10-19(11-9-17)32(28,29)25-12-1-2-13-25/h4-11,22H,1-3,12-15H2,(H,23,26)(H,24,27)