(4-methoxy-8-nitro-5,6-dihydropyrimido[4,5-b][1,4]benzothiazepin-6-yl)diazane

Systemtic Name: (4-methoxy-8-nitro-5,6-dihydropyrimido[4,5-b][1,4]benzothiazepin-6-yl)diazane Openeye Name: (4-methoxy-8-nitro-5,6-dihydropyrimido[4,5-b][1,4]benzothiazepin-6-yl)hydrazine CAS Name: (4-methoxy-8-nitro-5,6-dihydropyrimido[4,5-b][1,4]benzothiazepin-6-yl)hydrazine IUPAC Name: (4-methoxy-8-nitro-5,6-dihydropyrimido[4,5-b][1,4]benzothiazepin-6-yl)hydrazine Traditional Name: (4-methoxy-8-nitro-5,6-dihydropyrimido[4,5-b][1,4]benzothiazepin-6-yl)hydrazine Formula: C12H12N6O3S MolecularWeight: 320.32708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=NC=N1)SC3=C(C=C(C=C3)[N+](=O)[O-])C(N2)NN

Isomeric SMILES

COC1=C2C(=NC=N1)SC3=C(C=C(C=C3)[N+](=O)[O-])C(N2)NN

InChI

InChI=1S/C12H12N6O3S/c1-21-11-9-12(15-5-14-11)22-8-3-2-6(18(19)20)4-7(8)10(16-9)17-13/h2-5,10,16-17H,13H2,1H3