2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-thiophen-2-ylethyl)propanamide

Systemtic Name: 2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-thiophen-2-ylethyl)propanamide Openeye Name: 2-(6-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-(2-thienyl)ethyl]propanamide CAS Name: 2-[[6-chloro-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-N-(2-thiophen-2-ylethyl)propanamide IUPAC Name: 2-[6-chloro-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-thiophen-2-ylethyl)propanamide Traditional Name: 2-[(6-chloro-3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-[2-(2-thienyl)ethyl]propionamide Formula: C21H24ClN3O2S2 MolecularWeight: 450.01716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SC(C)C(=O)NCCC3=CC=CS3

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SC(C)C(=O)NCCC3=CC=CS3

InChI

InChI=1S/C21H24ClN3O2S2/c1-13(2)12-25-20(27)17-11-15(22)6-7-18(17)24-21(25)29-14(3)19(26)23-9-8-16-5-4-10-28-16/h4-7,10-11,13-14H,8-9,12H2,1-3H3,(H,23,26)