3-(cyclohexylcarbamoylamino)-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide

Systemtic Name: 3-(cyclohexylcarbamoylamino)-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide Openeye Name: 3-(cyclohexylcarbamoylamino)-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide CAS Name: 3-[[(cyclohexylamino)-oxomethyl]amino]-N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-(cyclohexylcarbamoylamino)-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 3-(cyclohexylcarbamoylamino)-N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)propionamide Formula: C20H30N4O5S MolecularWeight: 438.541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NCCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)O

Isomeric SMILES

C1CCC(CC1)NC(=O)NCCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)O

InChI

InChI=1S/C20H30N4O5S/c25-18-9-8-16(30(28,29)24-12-4-5-13-24)14-17(18)23-19(26)10-11-21-20(27)22-15-6-2-1-3-7-15/h8-9,14-15,25H,1-7,10-13H2,(H,23,26)(H2,21,22,27)