2-(5,8-dimethyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-(5,8-dimethyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-(2-nitrophenyl)ethanamide Openeye Name: 2-(5,8-dimethyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-(2-nitrophenyl)acetamide CAS Name: 2-[(5,8-dimethyl-2-phenyl-4-quinazolinyl)thio]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-(5,8-dimethyl-2-phenylquinazolin-4-yl)sulfanyl-N-(2-nitrophenyl)acetamide Traditional Name: 2-[(5,8-dimethyl-2-phenyl-quinazolin-4-yl)thio]-N-(2-nitrophenyl)acetamide Formula: C24H20N4O3S MolecularWeight: 444.5056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)N=C(N=C2SCC(=O)NC3=CC=CC=C3[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=C(C=C1)C)N=C(N=C2SCC(=O)NC3=CC=CC=C3[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C24H20N4O3S/c1-15-12-13-16(2)22-21(15)24(27-23(26-22)17-8-4-3-5-9-17)32-14-20(29)25-18-10-6-7-11-19(18)28(30)31/h3-13H,14H2,1-2H3,(H,25,29)