S-[[bis(2-methylpropyl)amino]methyl] 2-phenylethanethioate

Systemtic Name: S-[[bis(2-methylpropyl)amino]methyl] 2-phenylethanethioate Openeye Name: S-[(diisobutylamino)methyl] 2-phenylethanethioate CAS Name: 2-phenylethanethioic acid S-[[bis(2-methylpropyl)amino]methyl] ester IUPAC Name: S-[[bis(2-methylpropyl)amino]methyl] 2-phenylethanethioate Traditional Name: 2-phenylethanethioic acid S-[(diisobutylamino)methyl] ester Formula: C17H27NOS MolecularWeight: 293.46738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)CSC(=O)CC1=CC=CC=C1

Isomeric SMILES

CC(C)CN(CC(C)C)CSC(=O)CC1=CC=CC=C1

InChI

InChI=1S/C17H27NOS/c1-14(2)11-18(12-15(3)4)13-20-17(19)10-16-8-6-5-7-9-16/h5-9,14-15H,10-13H2,1-4H3