4-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanylmethyl)-3-nitro-benzamide

Systemtic Name: 4-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanylmethyl)-3-nitro-benzamide Openeye Name: 4-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanylmethyl)-3-nitro-benzamide CAS Name: 4-[(6-benzimidazolo[1,2-c]quinazolinylthio)methyl]-3-nitrobenzamide IUPAC Name: 4-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanylmethyl)-3-nitrobenzamide Traditional Name: 4-[(benzimidazolo[1,2-c]quinazolin-6-ylthio)methyl]-3-nitro-benzamide Formula: C22H15N5O3S MolecularWeight: 429.4512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=NC4=CC=CC=C4N3C(=N2)SCC5=C(C=C(C=C5)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C3=NC4=CC=CC=C4N3C(=N2)SCC5=C(C=C(C=C5)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C22H15N5O3S/c23-20(28)13-9-10-14(19(11-13)27(29)30)12-31-22-25-16-6-2-1-5-15(16)21-24-17-7-3-4-8-18(17)26(21)22/h1-11H,12H2,(H2,23,28)