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

Systemtic Name: N-[(4-chloranyl-3-nitro-phenyl)methylideneamino]-2-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(4-chloro-3-nitro-phenyl)methyleneamino]-2-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(4-chloro-3-nitrophenyl)methylideneamino]-2-[[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(4-chloro-3-nitrophenyl)methylideneamino]-2-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[(4-chloro-3-nitro-benzylidene)amino]-2-[(4-keto-3-p-phenetyl-quinazolin-2-yl)thio]acetamide Formula: C25H20ClN5O5S MolecularWeight: 537.9748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H20ClN5O5S/c1-2-36-18-10-8-17(9-11-18)30-24(33)19-5-3-4-6-21(19)28-25(30)37-15-23(32)29-27-14-16-7-12-20(26)22(13-16)31(34)35/h3-14H,2,15H2,1H3,(H,29,32)