N-butyl-3-methyl-5-nitro-N-(thiophen-2-ylmethyl)imidazol-4-amine

Systemtic Name: N-butyl-3-methyl-5-nitro-N-(thiophen-2-ylmethyl)imidazol-4-amine Openeye Name: N-butyl-3-methyl-5-nitro-N-(2-thienylmethyl)imidazol-4-amine CAS Name: N-butyl-3-methyl-5-nitro-N-(thiophen-2-ylmethyl)-4-imidazolamine IUPAC Name: N-butyl-3-methyl-5-nitro-N-(thiophen-2-ylmethyl)imidazol-4-amine Traditional Name: butyl-(3-methyl-5-nitro-imidazol-4-yl)-(2-thenyl)amine Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CS1)C2=C(N=CN2C)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC1=CC=CS1)C2=C(N=CN2C)[N+](=O)[O-]

InChI

InChI=1S/C13H18N4O2S/c1-3-4-7-16(9-11-6-5-8-20-11)13-12(17(18)19)14-10-15(13)2/h5-6,8,10H,3-4,7,9H2,1-2H3