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

Systemtic Name: 2-[7-chloranyl-3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-ethyl-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-2-[7-chloro-3-(3-ethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-ethyl-propanamide CAS Name: 2-[[7-chloro-3-(3-ethoxypropyl)-4-oxo-2-quinazolinyl]thio]-N-ethyl-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-2-[7-chloro-3-(3-ethoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-ethylpropanamide Traditional Name: N-benzyl-2-[[7-chloro-3-(3-ethoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-ethyl-propionamide Formula: C25H30ClN3O3S MolecularWeight: 488.042

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C(C)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCCOCC

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)C(C)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCCOCC

InChI

InChI=1S/C25H30ClN3O3S/c1-4-28(17-19-10-7-6-8-11-19)23(30)18(3)33-25-27-22-16-20(26)12-13-21(22)24(31)29(25)14-9-15-32-5-2/h6-8,10-13,16,18H,4-5,9,14-15,17H2,1-3H3