ethyl 2-[methyl-[(4-propan-2-ylphenyl)methyl]amino]-3-sulfanyl-propanoate

Systemtic Name: ethyl 2-[methyl-[(4-propan-2-ylphenyl)methyl]amino]-3-sulfanyl-propanoate Openeye Name: ethyl 2-[(4-isopropylphenyl)methyl-methyl-amino]-3-sulfanyl-propanoate CAS Name: 3-mercapto-2-[methyl-[(4-propan-2-ylphenyl)methyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 2-[methyl-[(4-propan-2-ylphenyl)methyl]amino]-3-sulfanylpropanoate Traditional Name: 2-[(4-isopropylbenzyl)-methyl-amino]-3-mercapto-propionic acid ethyl ester Formula: C16H25NO2S MolecularWeight: 295.4402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CS)N(C)CC1=CC=C(C=C1)C(C)C

Isomeric SMILES

CCOC(=O)C(CS)N(C)CC1=CC=C(C=C1)C(C)C

InChI

InChI=1S/C16H25NO2S/c1-5-19-16(18)15(11-20)17(4)10-13-6-8-14(9-7-13)12(2)3/h6-9,12,15,20H,5,10-11H2,1-4H3