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

Systemtic Name: (3-chlorophenyl)carbamodithioic acid; N,N-diethylethanamine Openeye Name: (3-chlorophenyl)carbamodithioic acid; N,N-diethylethanamine CAS Name: (3-chlorophenyl)carbamodithioic acid; N,N-diethylethanamine IUPAC Name: (3-chlorophenyl)carbamodithioic acid; N,N-diethylethanamine Traditional Name: (3-chlorophenyl)carbamodithioic acid; triethylamine Formula: C13H21ClN2S2 MolecularWeight: 304.90224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.C1=CC(=CC(=C1)Cl)NC(=S)S

Isomeric SMILES

CCN(CC)CC.C1=CC(=CC(=C1)Cl)NC(=S)S

InChI

InChI=1S/C7H6ClNS2.C6H15N/c8-5-2-1-3-6(4-5)9-7(10)11;1-4-7(5-2)6-3/h1-4H,(H2,9,10,11);4-6H2,1-3H3