8-nitropyrimido[4,5-b][1,4]benzothiazepin-4-amine

Systemtic Name: 8-nitropyrimido[4,5-b][1,4]benzothiazepin-4-amine Openeye Name: 8-nitropyrimido[4,5-b][1,4]benzothiazepin-4-amine CAS Name: 8-nitro-4-pyrimido[4,5-b][1,4]benzothiazepinamine IUPAC Name: 8-nitropyrimido[4,5-b][1,4]benzothiazepin-4-amine Traditional Name: (8-nitropyrimido[4,5-b][1,4]benzothiazepin-4-yl)amine Formula: C11H7N5O2S MolecularWeight: 273.27058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C=NC3=C(N=CN=C3S2)N

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C=NC3=C(N=CN=C3S2)N

InChI

InChI=1S/C11H7N5O2S/c12-10-9-11(15-5-14-10)19-8-2-1-7(16(17)18)3-6(8)4-13-9/h1-5H,(H2,12,14,15)