S-(2-methylpropyl) N-[2-[(4-chlorophenyl)methyl]pyridin-3-yl]carbamothioate

Systemtic Name: S-(2-methylpropyl) N-[2-[(4-chlorophenyl)methyl]pyridin-3-yl]carbamothioate Openeye Name: S-isobutyl N-[2-[(4-chlorophenyl)methyl]-3-pyridyl]carbamothioate CAS Name: N-[2-[(4-chlorophenyl)methyl]-3-pyridinyl]carbamothioic acid S-(2-methylpropyl) ester IUPAC Name: S-(2-methylpropyl) N-[2-[(4-chlorophenyl)methyl]pyridin-3-yl]carbamothioate Traditional Name: N-[2-(4-chlorobenzyl)-3-pyridyl]thiocarbamic acid S-isobutyl ester Formula: C17H19ClN2OS MolecularWeight: 334.86356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC(=O)NC1=C(N=CC=C1)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CSC(=O)NC1=C(N=CC=C1)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H19ClN2OS/c1-12(2)11-22-17(21)20-15-4-3-9-19-16(15)10-13-5-7-14(18)8-6-13/h3-9,12H,10-11H2,1-2H3,(H,20,21)