O-[(2,2-dimethyl-3H-1-benzofuran-7-yl)] N-(4-chlorophenyl)-N-methyl-carbamothioate

Systemtic Name: O-[(2,2-dimethyl-3H-1-benzofuran-7-yl)] N-(4-chlorophenyl)-N-methyl-carbamothioate Openeye Name: O-[(2,2-dimethyl-3H-benzofuran-7-yl)] N-(4-chlorophenyl)-N-methyl-carbamothioate CAS Name: N-(4-chlorophenyl)-N-methylcarbamothioic acid O-[(2,2-dimethyl-3H-benzofuran-7-yl)] ester IUPAC Name: O-[(2,2-dimethyl-3H-1-benzofuran-7-yl)] N-(4-chlorophenyl)-N-methylcarbamothioate Traditional Name: N-(4-chlorophenyl)-N-methyl-thiocarbamic acid O-(2,2-dimethylcoumaran-7-yl) ester Formula: C18H18ClNO2S MolecularWeight: 347.85902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OC(=S)N(C)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OC(=S)N(C)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C18H18ClNO2S/c1-18(2)11-12-5-4-6-15(16(12)22-18)21-17(23)20(3)14-9-7-13(19)8-10-14/h4-10H,11H2,1-3H3