2-[3-(3,4-dichlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methoxyphenyl)-2-phenyl-ethanamide

Systemtic Name: 2-[3-(3,4-dichlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methoxyphenyl)-2-phenyl-ethanamide Openeye Name: 2-[3-(3,4-dichlorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(3-methoxyphenyl)-2-phenyl-acetamide CAS Name: 2-[[3-(3,4-dichlorophenyl)-4-oxo-2-quinazolinyl]thio]-N-(3-methoxyphenyl)-2-phenylacetamide IUPAC Name: 2-[3-(3,4-dichlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-methoxyphenyl)-2-phenylacetamide Traditional Name: 2-[[3-(3,4-dichlorophenyl)-4-keto-quinazolin-2-yl]thio]-N-(3-methoxyphenyl)-2-phenyl-acetamide Formula: C29H21Cl2N3O3S MolecularWeight: 562.46634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3C5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3C5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C29H21Cl2N3O3S/c1-37-21-11-7-10-19(16-21)32-27(35)26(18-8-3-2-4-9-18)38-29-33-25-13-6-5-12-22(25)28(36)34(29)20-14-15-23(30)24(31)17-20/h2-17,26H,1H3,(H,32,35)