5-[(3-chloranylthiophen-2-yl)methyl]-3-nitro-2-propyl-pyridin-4-amine

Systemtic Name: 5-[(3-chloranylthiophen-2-yl)methyl]-3-nitro-2-propyl-pyridin-4-amine Openeye Name: 5-[(3-chloro-2-thienyl)methyl]-3-nitro-2-propyl-pyridin-4-amine CAS Name: 5-[(3-chloro-2-thiophenyl)methyl]-3-nitro-2-propyl-4-pyridinamine IUPAC Name: 5-[(3-chlorothiophen-2-yl)methyl]-3-nitro-2-propylpyridin-4-amine Traditional Name: [5-[(3-chloro-2-thienyl)methyl]-3-nitro-2-propyl-4-pyridyl]amine Formula: C13H14ClN3O2S MolecularWeight: 311.78716

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC=C(C(=C1[N+](=O)[O-])N)CC2=C(C=CS2)Cl

Isomeric SMILES

CCCC1=NC=C(C(=C1[N+](=O)[O-])N)CC2=C(C=CS2)Cl

InChI

InChI=1S/C13H14ClN3O2S/c1-2-3-10-13(17(18)19)12(15)8(7-16-10)6-11-9(14)4-5-20-11/h4-5,7H,2-3,6H2,1H3,(H2,15,16)