3-(aminocarbonylamino)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(2-fluorophenyl)propanamide

Systemtic Name: 3-(aminocarbonylamino)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(2-fluorophenyl)propanamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(2-fluorophenyl)-3-ureido-propanamide CAS Name: 3-(carbamoylamino)-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-3-(2-fluorophenyl)propanamide IUPAC Name: 3-(carbamoylamino)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-3-(2-fluorophenyl)propanamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-3-(2-fluorophenyl)-3-ureido-propionamide Formula: C22H27FN4O5S MolecularWeight: 478.536983

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CC(C2=CC=CC=C2F)NC(=O)N)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CC(C2=CC=CC=C2F)NC(=O)N)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H27FN4O5S/c1-2-32-19-10-9-15(13-20(19)33(30,31)27-11-5-6-12-27)25-21(28)14-18(26-22(24)29)16-7-3-4-8-17(16)23/h3-4,7-10,13,18H,2,5-6,11-12,14H2,1H3,(H,25,28)(H3,24,26,29)