N-(4-nitrophenyl)sulfanyl-11H-pyrimido[1,2-b][2,4]benzodiazepin-6-imine

Systemtic Name: N-(4-nitrophenyl)sulfanyl-11H-pyrimido[1,2-b][2,4]benzodiazepin-6-imine Openeye Name: N-(4-nitrophenyl)sulfanyl-11H-pyrimido[1,2-b][2,4]benzodiazepin-6-imine CAS Name: 4-nitro-N-(11H-pyrimido[1,2-b][2,4]benzodiazepin-6-ylidene)benzenesulfenamide IUPAC Name: N-(4-nitrophenyl)sulfanyl-11H-pyrimido[1,2-b][2,4]benzodiazepin-6-imine Traditional Name: [(4-nitrophenyl)thio]-(11H-pyrimido[1,2-b][2,4]benzodiazepin-6-ylidene)amine Formula: C18H13N5O2S MolecularWeight: 363.39312

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NSC3=CC=C(C=C3)[N+](=O)[O-])N=C4N1C=CC=N4

Isomeric SMILES

C1C2=CC=CC=C2C(=NSC3=CC=C(C=C3)[N+](=O)[O-])N=C4N1C=CC=N4

InChI

InChI=1S/C18H13N5O2S/c24-23(25)14-6-8-15(9-7-14)26-21-17-16-5-2-1-4-13(16)12-22-11-3-10-19-18(22)20-17/h1-11H,12H2