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

Systemtic Name: 2-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methyl-2-nitro-phenyl)ethanamide Openeye Name: 2-[3-[(4-methoxyphenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-(4-methyl-2-nitro-phenyl)acetamide CAS Name: 2-[[3-[(4-methoxyphenyl)methyl]-4-oxo-2-quinazolinyl]thio]-N-(4-methyl-2-nitrophenyl)acetamide IUPAC Name: 2-[3-[(4-methoxyphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-(4-methyl-2-nitrophenyl)acetamide Traditional Name: 2-[(4-keto-3-p-anisyl-quinazolin-2-yl)thio]-N-(4-methyl-2-nitro-phenyl)acetamide Formula: C25H22N4O5S MolecularWeight: 490.53098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C25H22N4O5S/c1-16-7-12-21(22(13-16)29(32)33)26-23(30)15-35-25-27-20-6-4-3-5-19(20)24(31)28(25)14-17-8-10-18(34-2)11-9-17/h3-13H,14-15H2,1-2H3,(H,26,30)