N,N-diethylethanamine; (3-nitrophenyl)carbamodithioic acid

Systemtic Name: N,N-diethylethanamine; (3-nitrophenyl)carbamodithioic acid Openeye Name: N,N-diethylethanamine; (3-nitrophenyl)carbamodithioic acid CAS Name: N,N-diethylethanamine; (3-nitrophenyl)carbamodithioic acid IUPAC Name: N,N-diethylethanamine; (3-nitrophenyl)carbamodithioic acid Traditional Name: (3-nitrophenyl)carbamodithioic acid; triethylamine Formula: C13H21N3O2S2 MolecularWeight: 315.45474

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.C1=CC(=CC(=C1)[N+](=O)[O-])NC(=S)S

Isomeric SMILES

CCN(CC)CC.C1=CC(=CC(=C1)[N+](=O)[O-])NC(=S)S

InChI

InChI=1S/C7H6N2O2S2.C6H15N/c10-9(11)6-3-1-2-5(4-6)8-7(12)13;1-4-7(5-2)6-3/h1-4H,(H2,8,12,13);4-6H2,1-3H3