N-(3-chloranyl-4-cyano-phenyl)-3-(2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-3-(2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-3-(2-oxo-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanamide CAS Name: N-(3-chloro-4-cyanophenyl)-3-[2-oxo-6-(1-pyrrolidinylsulfonyl)-1,3-benzoxazol-3-yl]propanamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-3-(2-oxo-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-3-(2-keto-6-pyrrolidinosulfonyl-1,3-benzoxazol-3-yl)propionamide Formula: C21H19ClN4O5S MolecularWeight: 474.91736

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCC(=O)NC4=CC(=C(C=C4)C#N)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCC(=O)NC4=CC(=C(C=C4)C#N)Cl

InChI

InChI=1S/C21H19ClN4O5S/c22-17-11-15(4-3-14(17)13-23)24-20(27)7-10-26-18-6-5-16(12-19(18)31-21(26)28)32(29,30)25-8-1-2-9-25/h3-6,11-12H,1-2,7-10H2,(H,24,27)