2-azanyl-2-[(E)-2-azanyl-2-nitro-ethenyl]-N,N-diethyl-3-sulfanylidene-pentanamide dihydrochloride

Systemtic Name: 2-azanyl-2-[(E)-2-azanyl-2-nitro-ethenyl]-N,N-diethyl-3-sulfanylidene-pentanamide dihydrochloride Openeye Name: 2-amino-2-[(E)-2-amino-2-nitro-vinyl]-N,N-diethyl-3-thioxo-pentanamide dihydrochloride CAS Name: 2-amino-2-[(E)-2-amino-2-nitroethenyl]-N,N-diethyl-3-sulfanylidenepentanamide dihydrochloride IUPAC Name: 2-amino-2-[(E)-2-amino-2-nitroethenyl]-N,N-diethyl-3-sulfanylidenepentanamide dihydrochloride Traditional Name: (E)-2,4-diamino-N,N-diethyl-4-nitro-2-propanethioyl-but-3-enamide dihydrochloride Formula: C11H22Cl2N4O3S MolecularWeight: 361.28838

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=S)C(C=C(N)[N+](=O)[O-])(C(=O)N(CC)CC)N.Cl.Cl

Isomeric SMILES

CCC(=S)C(/C=C(\N)/[N+](=O)[O-])(C(=O)N(CC)CC)N.Cl.Cl

InChI

InChI=1S/C11H20N4O3S.2ClH/c1-4-8(19)11(13,7-9(12)15(17)18)10(16)14(5-2)6-3;;/h7H,4-6,12-13H2,1-3H3;2*1H/b9-7+;;