O-(2-diethylaminoethyl) 4-tert-butylbenzenecarbothioate

Systemtic Name: O-(2-diethylaminoethyl) 4-tert-butylbenzenecarbothioate Openeye Name: O-(2-diethylaminoethyl) 4-tert-butylbenzenecarbothioate CAS Name: 4-tert-butylbenzenecarbothioic acid O-(2-diethylaminoethyl) ester IUPAC Name: O-(2-diethylaminoethyl) 4-tert-butylbenzenecarbothioate Traditional Name: 4-tert-butylthiobenzoic acid O-(2-diethylaminoethyl) ester Formula: C17H27NOS MolecularWeight: 293.46738

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=S)C1=CC=C(C=C1)C(C)(C)C

Isomeric SMILES

CCN(CC)CCOC(=S)C1=CC=C(C=C1)C(C)(C)C

InChI

InChI=1S/C17H27NOS/c1-6-18(7-2)12-13-19-16(20)14-8-10-15(11-9-14)17(3,4)5/h8-11H,6-7,12-13H2,1-5H3