(3E)-3-[(4-methylsulfanylphenyl)methylidene]-7-nitro-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one

Systemtic Name: (3E)-3-[(4-methylsulfanylphenyl)methylidene]-7-nitro-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one Openeye Name: (3E)-3-[(4-methylsulfanylphenyl)methylene]-7-nitro-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one CAS Name: (3E)-3-[[4-(methylthio)phenyl]methylidene]-7-nitro-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one IUPAC Name: (3E)-3-[(4-methylsulfanylphenyl)methylidene]-7-nitro-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one Traditional Name: (3E)-3-[4-(methylthio)benzylidene]-7-nitro-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one Formula: C19H15N3O3S MolecularWeight: 365.4057

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C2CCN3C2=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/2\CCN3C2=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H15N3O3S/c1-26-15-5-2-12(3-6-15)10-13-8-9-21-18(13)20-17-7-4-14(22(24)25)11-16(17)19(21)23/h2-7,10-11H,8-9H2,1H3/b13-10+