5-[(4-nitrophenyl)methyl]-4-propyl-1,3-thiazol-2-amine

Systemtic Name: 5-[(4-nitrophenyl)methyl]-4-propyl-1,3-thiazol-2-amine Openeye Name: 5-[(4-nitrophenyl)methyl]-4-propyl-thiazol-2-amine CAS Name: 5-[(4-nitrophenyl)methyl]-4-propyl-2-thiazolamine IUPAC Name: 5-[(4-nitrophenyl)methyl]-4-propyl-1,3-thiazol-2-amine Traditional Name: [5-(4-nitrobenzyl)-4-propyl-thiazol-2-yl]amine Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SC(=N1)N)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC1=C(SC(=N1)N)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O2S/c1-2-3-11-12(19-13(14)15-11)8-9-4-6-10(7-5-9)16(17)18/h4-7H,2-3,8H2,1H3,(H2,14,15)