4-tert-butyl-2-(2-diethylaminoethyl)benzenecarbothioic S-acid hydrochloride

Systemtic Name: 4-tert-butyl-2-(2-diethylaminoethyl)benzenecarbothioic S-acid hydrochloride Openeye Name: 4-tert-butyl-2-(2-diethylaminoethyl)benzenecarbothioic S-acid hydrochloride CAS Name: 4-tert-butyl-2-(2-diethylaminoethyl)benzenecarbothioic S-acid hydrochloride IUPAC Name: 4-tert-butyl-2-(2-diethylaminoethyl)benzenecarbothioic S-acid hydrochloride Traditional Name: 4-tert-butyl-2-(2-diethylaminoethyl)thiobenzoic acid hydrochloride Formula: C17H28ClNOS MolecularWeight: 329.92832

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1=C(C=CC(=C1)C(C)(C)C)C(=O)S.Cl

Isomeric SMILES

CCN(CC)CCC1=C(C=CC(=C1)C(C)(C)C)C(=O)S.Cl

InChI

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