5-[4-[4-(azanylidenemethylidene)piperazin-4-ium-1-yl]-3-nitro-phenyl]-3,6-dihydro-1,3,4-thiadiazin-2-one

Systemtic Name: 5-[4-[4-(azanylidenemethylidene)piperazin-4-ium-1-yl]-3-nitro-phenyl]-3,6-dihydro-1,3,4-thiadiazin-2-one Openeye Name: 5-[4-[4-(iminomethylene)piperazin-4-ium-1-yl]-3-nitro-phenyl]-3,6-dihydro-1,3,4-thiadiazin-2-one CAS Name: 5-[4-[4-(iminomethylidene)-1-piperazin-4-iumyl]-3-nitrophenyl]-3,6-dihydro-1,3,4-thiadiazin-2-one IUPAC Name: 5-[4-[4-(iminomethylidene)piperazin-4-ium-1-yl]-3-nitrophenyl]-3,6-dihydro-1,3,4-thiadiazin-2-one Traditional Name: 5-[4-[4-(iminomethylene)piperazin-4-ium-1-yl]-3-nitro-phenyl]-3,6-dihydro-1,3,4-thiadiazin-2-one Formula: C14H15N6O3S+ MolecularWeight: 347.3723

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=C=N)CCN1C2=C(C=C(C=C2)C3=NNC(=O)SC3)[N+](=O)[O-]

Isomeric SMILES

C1C[N+](=C=N)CCN1C2=C(C=C(C=C2)C3=NNC(=O)SC3)[N+](=O)[O-]

InChI

InChI=1S/C14H14N6O3S/c15-9-18-3-5-19(6-4-18)12-2-1-10(7-13(12)20(22)23)11-8-24-14(21)17-16-11/h1-2,7,15H,3-6,8H2/p+1