2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-methoxyphenyl)-2-phenyl-ethanamide

Systemtic Name: 2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-methoxyphenyl)-2-phenyl-ethanamide Openeye Name: 2-(3,6-dimethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-methoxyphenyl)-2-phenyl-acetamide CAS Name: 2-[(3,6-dimethyl-4-oxo-2-quinazolinyl)thio]-N-(4-methoxyphenyl)-2-phenylacetamide IUPAC Name: 2-(3,6-dimethyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-methoxyphenyl)-2-phenylacetamide Traditional Name: 2-[(4-keto-3,6-dimethyl-quinazolin-2-yl)thio]-N-(4-methoxyphenyl)-2-phenyl-acetamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N(C2=O)C)SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N(C2=O)C)SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H23N3O3S/c1-16-9-14-21-20(15-16)24(30)28(2)25(27-21)32-22(17-7-5-4-6-8-17)23(29)26-18-10-12-19(31-3)13-11-18/h4-15,22H,1-3H3,(H,26,29)