dimethyl-[3-(4-nitrophenyl)-2-[(4-nitrophenyl)methyl]-1,2,4-thiadiazol-5-ylidene]azanium

Systemtic Name: dimethyl-[3-(4-nitrophenyl)-2-[(4-nitrophenyl)methyl]-1,2,4-thiadiazol-5-ylidene]azanium Openeye Name: dimethyl-[3-(4-nitrophenyl)-2-[(4-nitrophenyl)methyl]-1,2,4-thiadiazol-5-ylidene]ammonium CAS Name: dimethyl-[3-(4-nitrophenyl)-2-[(4-nitrophenyl)methyl]-1,2,4-thiadiazol-5-ylidene]ammonium IUPAC Name: dimethyl-[3-(4-nitrophenyl)-2-[(4-nitrophenyl)methyl]-1,2,4-thiadiazol-5-ylidene]azanium Traditional Name: dimethyl-[2-(4-nitrobenzyl)-3-(4-nitrophenyl)-1,2,4-thiadiazol-5-ylidene]ammonium Formula: C17H16N5O4S+ MolecularWeight: 386.40504

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=C1N=C(N(S1)CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

C[N+](=C1N=C(N(S1)CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C17H16N5O4S/c1-19(2)17-18-16(13-5-9-15(10-6-13)22(25)26)20(27-17)11-12-3-7-14(8-4-12)21(23)24/h3-10H,11H2,1-2H3/q+1