N-butyl-5-(4-methyl-3-nitro-phenyl)-6H-1,3,4-thiadiazin-2-amine

Systemtic Name: N-butyl-5-(4-methyl-3-nitro-phenyl)-6H-1,3,4-thiadiazin-2-amine Openeye Name: N-butyl-5-(4-methyl-3-nitro-phenyl)-6H-1,3,4-thiadiazin-2-amine CAS Name: N-butyl-5-(4-methyl-3-nitrophenyl)-6H-1,3,4-thiadiazin-2-amine IUPAC Name: N-butyl-5-(4-methyl-3-nitrophenyl)-6H-1,3,4-thiadiazin-2-amine Traditional Name: butyl-[5-(4-methyl-3-nitro-phenyl)-6H-1,3,4-thiadiazin-2-yl]amine Formula: C14H18N4O2S MolecularWeight: 306.38332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(CS1)C2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=NN=C(CS1)C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O2S/c1-3-4-7-15-14-17-16-12(9-21-14)11-6-5-10(2)13(8-11)18(19)20/h5-6,8H,3-4,7,9H2,1-2H3,(H,15,17)