N-tert-butyl-2-[7-chloranyl-3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-tert-butyl-2-[7-chloranyl-3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-tert-butyl-2-[7-chloro-3-(3-ethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-tert-butyl-2-[[7-chloro-3-(3-ethoxypropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-tert-butyl-2-[7-chloro-3-(3-ethoxypropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-tert-butyl-2-[[7-chloro-3-(3-ethoxypropyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C20H28ClN3O3S MolecularWeight: 425.97262

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC(C)(C)C

Isomeric SMILES

CCOCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC(C)(C)C

InChI

InChI=1S/C20H28ClN3O3S/c1-6-27-11-7-10-24-18(26)15-9-8-14(21)12-16(15)22-19(24)28-13(2)17(25)23-20(3,4)5/h8-9,12-13H,6-7,10-11H2,1-5H3,(H,23,25)