S-(phenylmethyl) N,N-di(butan-2-yl)carbamothioate

Systemtic Name: S-(phenylmethyl) N,N-di(butan-2-yl)carbamothioate Openeye Name: S-benzyl N,N-disec-butylcarbamothioate CAS Name: N,N-di(butan-2-yl)carbamothioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl N,N-di(butan-2-yl)carbamothioate Traditional Name: N,N-disec-butylthiocarbamic acid S-benzyl ester Formula: C16H25NOS MolecularWeight: 279.4408

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C(C)CC)C(=O)SCC1=CC=CC=C1

Isomeric SMILES

CCC(C)N(C(C)CC)C(=O)SCC1=CC=CC=C1

InChI

InChI=1S/C16H25NOS/c1-5-13(3)17(14(4)6-2)16(18)19-12-15-10-8-7-9-11-15/h7-11,13-14H,5-6,12H2,1-4H3