2-chloranyl-N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]butan-2-yl]benzamide Openeye Name: 2-chloro-N-[(1S)-3-methylsulfanyl-1-[(3-pyrrolidin-1-ylsulfonylphenyl)carbamoyl]propyl]benzamide CAS Name: 2-chloro-N-[(2S)-4-(methylthio)-1-oxo-1-[3-(1-pyrrolidinylsulfonyl)anilino]butan-2-yl]benzamide IUPAC Name: 2-chloro-N-[(2S)-4-methylsulfanyl-1-oxo-1-(3-pyrrolidin-1-ylsulfonylanilino)butan-2-yl]benzamide Traditional Name: 2-chloro-N-[(1S)-3-(methylthio)-1-[(3-pyrrolidinosulfonylphenyl)carbamoyl]propyl]benzamide Formula: C22H26ClN3O4S2 MolecularWeight: 496.04254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CSCC[C@@H](C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H26ClN3O4S2/c1-31-14-11-20(25-21(27)18-9-2-3-10-19(18)23)22(28)24-16-7-6-8-17(15-16)32(29,30)26-12-4-5-13-26/h2-3,6-10,15,20H,4-5,11-14H2,1H3,(H,24,28)(H,25,27)/t20-/m0/s1