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

Systemtic Name: N-(3-methylbutyl)-5-(4-methyl-3-nitro-phenyl)-6H-1,3,4-thiadiazin-2-amine Openeye Name: N-isopentyl-5-(4-methyl-3-nitro-phenyl)-6H-1,3,4-thiadiazin-2-amine CAS Name: N-(3-methylbutyl)-5-(4-methyl-3-nitrophenyl)-6H-1,3,4-thiadiazin-2-amine IUPAC Name: N-(3-methylbutyl)-5-(4-methyl-3-nitrophenyl)-6H-1,3,4-thiadiazin-2-amine Traditional Name: isoamyl-[5-(4-methyl-3-nitro-phenyl)-6H-1,3,4-thiadiazin-2-yl]amine Formula: C15H20N4O2S MolecularWeight: 320.4099

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(SC2)NCCC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(SC2)NCCC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H20N4O2S/c1-10(2)6-7-16-15-18-17-13(9-22-15)12-5-4-11(3)14(8-12)19(20)21/h4-5,8,10H,6-7,9H2,1-3H3,(H,16,18)