S-(2-diethylaminoethyl) 4-azanyl-2-hexoxy-benzenecarbothioate

Systemtic Name: S-(2-diethylaminoethyl) 4-azanyl-2-hexoxy-benzenecarbothioate Openeye Name: S-(2-diethylaminoethyl) 4-amino-2-hexoxy-benzenecarbothioate CAS Name: 4-amino-2-hexoxybenzenecarbothioic acid S-(2-diethylaminoethyl) ester IUPAC Name: S-(2-diethylaminoethyl) 4-amino-2-hexoxybenzenecarbothioate Traditional Name: 4-amino-2-hexoxy-thiobenzoic acid S-(2-diethylaminoethyl) ester Formula: C19H32N2O2S MolecularWeight: 352.53458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=CC(=C1)N)C(=O)SCCN(CC)CC

Isomeric SMILES

CCCCCCOC1=C(C=CC(=C1)N)C(=O)SCCN(CC)CC

InChI

InChI=1S/C19H32N2O2S/c1-4-7-8-9-13-23-18-15-16(20)10-11-17(18)19(22)24-14-12-21(5-2)6-3/h10-11,15H,4-9,12-14,20H2,1-3H3