3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)propanamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)propanamide Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)propanamide CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-(2-amino-2-oxoethyl)sulfanyl-N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 3-[(2-amino-2-keto-ethyl)thio]-N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)propionamide Formula: C15H20ClN3O4S2 MolecularWeight: 405.92

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CCSCC(=O)N)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CCSCC(=O)N)Cl

InChI

InChI=1S/C15H20ClN3O4S2/c16-12-4-3-11(18-15(21)5-8-24-10-14(17)20)9-13(12)25(22,23)19-6-1-2-7-19/h3-4,9H,1-2,5-8,10H2,(H2,17,20)(H,18,21)