N-ethylethanamine; S-(triphenylmethyl) ethanethioate

Systemtic Name: N-ethylethanamine; S-(triphenylmethyl) ethanethioate Openeye Name: N-ethylethanamine; S-trityl ethanethioate CAS Name: ethanethioic acid S-(triphenylmethyl) ester; N-ethylethanamine IUPAC Name: N-ethylethanamine; S-trityl ethanethioate Traditional Name: diethylamine; ethanethioic acid S-trityl ester Formula: C25H29NOS MolecularWeight: 391.56886

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC.CC(=O)SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCNCC.CC(=O)SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H18OS.C4H11N/c1-17(22)23-21(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20;1-3-5-4-2/h2-16H,1H3;5H,3-4H2,1-2H3