N-[3-(4-methoxyphenyl)-2-methyl-4-oxidanylidene-quinazolin-6-yl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[3-(4-methoxyphenyl)-2-methyl-4-oxidanylidene-quinazolin-6-yl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[3-(4-methoxyphenyl)-2-methyl-4-oxo-quinazolin-6-yl]acetamide CAS Name: N-[3-(4-methoxyphenyl)-2-methyl-4-oxo-6-quinazolinyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]acetamide Traditional Name: 2-(benzylthio)-N-[4-keto-3-(4-methoxyphenyl)-2-methyl-quinazolin-6-yl]acetamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC(=O)CSCC3=CC=CC=C3)C(=O)N1C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC(=O)CSCC3=CC=CC=C3)C(=O)N1C4=CC=C(C=C4)OC

InChI

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