2-methyl-4-[(2-nitrophenyl)methyl]piperazine-1-carbodithioic acid

Systemtic Name: 2-methyl-4-[(2-nitrophenyl)methyl]piperazine-1-carbodithioic acid Openeye Name: 2-methyl-4-[(2-nitrophenyl)methyl]piperazine-1-carbodithioic acid CAS Name: 2-methyl-4-[(2-nitrophenyl)methyl]-1-piperazinecarbodithioic acid IUPAC Name: 2-methyl-4-[(2-nitrophenyl)methyl]piperazine-1-carbodithioic acid Traditional Name: 2-methyl-4-(2-nitrobenzyl)piperazine-1-carbodithioic acid Formula: C13H17N3O2S2 MolecularWeight: 311.42298

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=S)S)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1CN(CCN1C(=S)S)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O2S2/c1-10-8-14(6-7-15(10)13(19)20)9-11-4-2-3-5-12(11)16(17)18/h2-5,10H,6-9H2,1H3,(H,19,20)