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

Systemtic Name: 2-[7-chloranyl-3-(2-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-2-[7-chloro-3-(2-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: 2-[[7-chloro-3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-2-[7-chloro-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-benzyl-2-[[7-chloro-4-keto-3-(2-methoxyphenyl)quinazolin-2-yl]thio]propionamide Formula: C25H22ClN3O3S MolecularWeight: 479.97848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=CC=C4OC

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=CC=C4OC

InChI

InChI=1S/C25H22ClN3O3S/c1-16(23(30)27-15-17-8-4-3-5-9-17)33-25-28-20-14-18(26)12-13-19(20)24(31)29(25)21-10-6-7-11-22(21)32-2/h3-14,16H,15H2,1-2H3,(H,27,30)