3-[5-[(3-nitrophenyl)methylsulfanyl]-3-oxidanylidene-2H-imidazo[1,2-c]quinazolin-2-yl]-N-phenethyl-propanamide

Systemtic Name: 3-[5-[(3-nitrophenyl)methylsulfanyl]-3-oxidanylidene-2H-imidazo[1,2-c]quinazolin-2-yl]-N-phenethyl-propanamide Openeye Name: 3-[5-[(3-nitrophenyl)methylsulfanyl]-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]-N-phenethyl-propanamide CAS Name: 3-[5-[(3-nitrophenyl)methylthio]-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]-N-phenethylpropanamide IUPAC Name: 3-[5-[(3-nitrophenyl)methylsulfanyl]-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]-N-phenethylpropanamide Traditional Name: 3-[3-keto-5-[(3-nitrobenzyl)thio]-2H-imidazo[1,2-c]quinazolin-2-yl]-N-phenethyl-propionamide Formula: C28H25N5O4S MolecularWeight: 527.5942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CCC2C(=O)N3C(=N2)C4=CC=CC=C4N=C3SCC5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CCC2C(=O)N3C(=N2)C4=CC=CC=C4N=C3SCC5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H25N5O4S/c34-25(29-16-15-19-7-2-1-3-8-19)14-13-24-27(35)32-26(30-24)22-11-4-5-12-23(22)31-28(32)38-18-20-9-6-10-21(17-20)33(36)37/h1-12,17,24H,13-16,18H2,(H,29,34)