N-(cyclopentylcarbamoyl)-3-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide

Systemtic Name: N-(cyclopentylcarbamoyl)-3-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide Openeye Name: N-(cyclopentylcarbamoyl)-3-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide CAS Name: N-[(cyclopentylamino)-oxomethyl]-3-[[2-(trifluoromethyl)-4-quinazolinyl]thio]propanamide IUPAC Name: N-(cyclopentylcarbamoyl)-3-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylpropanamide Traditional Name: N-(cyclopentylcarbamoyl)-3-[[2-(trifluoromethyl)quinazolin-4-yl]thio]propionamide Formula: C18H19F3N4O2S MolecularWeight: 412.42927

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)NC(=O)CCSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

C1CCC(C1)NC(=O)NC(=O)CCSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C18H19F3N4O2S/c19-18(20,21)16-23-13-8-4-3-7-12(13)15(25-16)28-10-9-14(26)24-17(27)22-11-5-1-2-6-11/h3-4,7-8,11H,1-2,5-6,9-10H2,(H2,22,24,26,27)