(Z)-1-[3-azanylpropyl-[(6-chloranylpyridin-3-yl)methyl]amino]-2-nitro-ethenethiol

Systemtic Name: (Z)-1-[3-azanylpropyl-[(6-chloranylpyridin-3-yl)methyl]amino]-2-nitro-ethenethiol Openeye Name: (Z)-1-[3-aminopropyl-[(6-chloro-3-pyridyl)methyl]amino]-2-nitro-ethenethiol CAS Name: (Z)-1-[3-aminopropyl-[(6-chloro-3-pyridinyl)methyl]amino]-2-nitroethenethiol IUPAC Name: (Z)-1-[3-aminopropyl-[(6-chloropyridin-3-yl)methyl]amino]-2-nitroethenethiol Traditional Name: (Z)-1-[3-aminopropyl-[(6-chloro-3-pyridyl)methyl]amino]-2-nitro-ethenethiol Formula: C11H15ClN4O2S MolecularWeight: 302.7804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1CN(CCCN)C(=C[N+](=O)[O-])S)Cl

Isomeric SMILES

C1=CC(=NC=C1CN(CCCN)/C(=C/[N+](=O)[O-])/S)Cl

InChI

InChI=1S/C11H15ClN4O2S/c12-10-3-2-9(6-14-10)7-15(5-1-4-13)11(19)8-16(17)18/h2-3,6,8,19H,1,4-5,7,13H2/b11-8-