2-[ethyl-[(4-propan-2-ylphenyl)methyl]amino]-3-sulfanyl-propanoic acid hydrochloride

Systemtic Name: 2-[ethyl-[(4-propan-2-ylphenyl)methyl]amino]-3-sulfanyl-propanoic acid hydrochloride Openeye Name: 2-[ethyl-[(4-isopropylphenyl)methyl]amino]-3-sulfanyl-propanoic acid hydrochloride CAS Name: 2-[ethyl-[(4-propan-2-ylphenyl)methyl]amino]-3-mercaptopropanoic acid hydrochloride IUPAC Name: 2-[ethyl-[(4-propan-2-ylphenyl)methyl]amino]-3-sulfanylpropanoic acid hydrochloride Traditional Name: 2-[ethyl-(4-isopropylbenzyl)amino]-3-mercapto-propionic acid hydrochloride Formula: C15H24ClNO2S MolecularWeight: 317.87456

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)C(C)C)C(CS)C(=O)O.Cl

Isomeric SMILES

CCN(CC1=CC=C(C=C1)C(C)C)C(CS)C(=O)O.Cl

InChI

InChI=1S/C15H23NO2S.ClH/c1-4-16(14(10-19)15(17)18)9-12-5-7-13(8-6-12)11(2)3;/h5-8,11,14,19H,4,9-10H2,1-3H3,(H,17,18);1H