S-propan-2-yl N-(4-phenylbutyl)carbamothioate

Systemtic Name: S-propan-2-yl N-(4-phenylbutyl)carbamothioate Openeye Name: S-isopropyl N-(4-phenylbutyl)carbamothioate CAS Name: N-(4-phenylbutyl)carbamothioic acid S-propan-2-yl ester IUPAC Name: S-propan-2-yl N-(4-phenylbutyl)carbamothioate Traditional Name: N-(4-phenylbutyl)thiocarbamic acid S-isopropyl ester Formula: C14H21NOS MolecularWeight: 251.38764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC(=O)NCCCCC1=CC=CC=C1

Isomeric SMILES

CC(C)SC(=O)NCCCCC1=CC=CC=C1

InChI

InChI=1S/C14H21NOS/c1-12(2)17-14(16)15-11-7-6-10-13-8-4-3-5-9-13/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,15,16)