N,N-diethylethanamine; [(2S)-1-phenylpropan-2-yl]carbamodithioic acid

Systemtic Name: N,N-diethylethanamine; [(2S)-1-phenylpropan-2-yl]carbamodithioic acid Openeye Name: N,N-diethylethanamine; [(1S)-1-methyl-2-phenyl-ethyl]carbamodithioic acid CAS Name: N,N-diethylethanamine; [(2S)-1-phenylpropan-2-yl]carbamodithioic acid IUPAC Name: N,N-diethylethanamine; [(2S)-1-phenylpropan-2-yl]carbamodithioic acid Traditional Name: [(1S)-1-methyl-2-phenyl-ethyl]carbamodithioic acid; triethylamine Formula: C16H28N2S2 MolecularWeight: 312.53692

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.CC(CC1=CC=CC=C1)NC(=S)S

Isomeric SMILES

CCN(CC)CC.C[C@@H](CC1=CC=CC=C1)NC(=S)S

InChI

InChI=1S/C10H13NS2.C6H15N/c1-8(11-10(12)13)7-9-5-3-2-4-6-9;1-4-7(5-2)6-3/h2-6,8H,7H2,1H3,(H2,11,12,13);4-6H2,1-3H3/t8-;/m0./s1