N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-3-pyrrolidinosulfonyl-benzamide Formula: C19H21N3O4S2 MolecularWeight: 419.51774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC=C3SCC(=O)N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC=C3SCC(=O)N

InChI

InChI=1S/C19H21N3O4S2/c20-18(23)13-27-17-9-2-1-8-16(17)21-19(24)14-6-5-7-15(12-14)28(25,26)22-10-3-4-11-22/h1-2,5-9,12H,3-4,10-11,13H2,(H2,20,23)(H,21,24)