S-(2-diethylaminoethyl) 2-butylbenzenecarbothioate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC=C1C(=O)SCCN(CC)CC

Isomeric SMILES

CCCCC1=CC=CC=C1C(=O)SCCN(CC)CC

InChI

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