N-[3-(4-methoxyphenyl)-2-methyl-4-oxidanylidene-quinazolin-6-yl]-3-phenylsulfanyl-propanamide

Systemtic Name: N-[3-(4-methoxyphenyl)-2-methyl-4-oxidanylidene-quinazolin-6-yl]-3-phenylsulfanyl-propanamide Openeye Name: N-[3-(4-methoxyphenyl)-2-methyl-4-oxo-quinazolin-6-yl]-3-phenylsulfanyl-propanamide CAS Name: N-[3-(4-methoxyphenyl)-2-methyl-4-oxo-6-quinazolinyl]-3-(phenylthio)propanamide IUPAC Name: N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]-3-phenylsulfanylpropanamide Traditional Name: N-[4-keto-3-(4-methoxyphenyl)-2-methyl-quinazolin-6-yl]-3-(phenylthio)propionamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC(=O)CCSC3=CC=CC=C3)C(=O)N1C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC(=O)CCSC3=CC=CC=C3)C(=O)N1C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H23N3O3S/c1-17-26-23-13-8-18(27-24(29)14-15-32-21-6-4-3-5-7-21)16-22(23)25(30)28(17)19-9-11-20(31-2)12-10-19/h3-13,16H,14-15H2,1-2H3,(H,27,29)