N-(1,3-benzodioxol-5-ylmethyl)-2-(7-chloranyl-3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(7-chloranyl-3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(7-chloro-3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(7-chloro-3-cyclopentyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(7-chloro-3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: 2-[(7-chloro-3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-piperonyl-propionamide Formula: C24H24ClN3O4S MolecularWeight: 485.98306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)SC3=NC4=C(C=CC(=C4)Cl)C(=O)N3C5CCCC5

Isomeric SMILES

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)SC3=NC4=C(C=CC(=C4)Cl)C(=O)N3C5CCCC5

InChI

InChI=1S/C24H24ClN3O4S/c1-14(22(29)26-12-15-6-9-20-21(10-15)32-13-31-20)33-24-27-19-11-16(25)7-8-18(19)23(30)28(24)17-4-2-3-5-17/h6-11,14,17H,2-5,12-13H2,1H3,(H,26,29)