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

Systemtic Name: 2-[3-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-ethoxy-2-nitro-phenyl)ethanamide Openeye Name: 2-[3-(3-chloro-2-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(4-ethoxy-2-nitro-phenyl)acetamide CAS Name: 2-[[3-(3-chloro-2-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(4-ethoxy-2-nitrophenyl)acetamide IUPAC Name: 2-[3-(3-chloro-2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-ethoxy-2-nitrophenyl)acetamide Traditional Name: 2-[[3-(3-chloro-2-methyl-phenyl)-4-keto-quinazolin-2-yl]thio]-N-(4-ethoxy-2-nitro-phenyl)acetamide Formula: C25H21ClN4O5S MolecularWeight: 524.97604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=C(C(=CC=C4)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=C(C(=CC=C4)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C25H21ClN4O5S/c1-3-35-16-11-12-20(22(13-16)30(33)34)27-23(31)14-36-25-28-19-9-5-4-7-17(19)24(32)29(25)21-10-6-8-18(26)15(21)2/h4-13H,3,14H2,1-2H3,(H,27,31)