S-[(2,2-dimethyl-3H-1-benzofuran-7-yl)] N-carbonocyanidoyl-N-methyl-carbamothioate

Systemtic Name: S-[(2,2-dimethyl-3H-1-benzofuran-7-yl)] N-carbonocyanidoyl-N-methyl-carbamothioate Openeye Name: S-[(2,2-dimethyl-3H-benzofuran-7-yl)] N-carbonocyanidoyl-N-methyl-carbamothioate CAS Name: N-carbonocyanidoyl-N-methylcarbamothioic acid S-[(2,2-dimethyl-3H-benzofuran-7-yl)] ester IUPAC Name: S-[(2,2-dimethyl-3H-1-benzofuran-7-yl)] N-carbonocyanidoyl-N-methylcarbamothioate Traditional Name: N-carbonocyanidoyl-N-methyl-thiocarbamic acid S-(2,2-dimethylcoumaran-7-yl) ester Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)SC(=O)N(C)C(=O)C#N)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)SC(=O)N(C)C(=O)C#N)C

InChI

InChI=1S/C14H14N2O3S/c1-14(2)7-9-5-4-6-10(12(9)19-14)20-13(18)16(3)11(17)8-15/h4-6H,7H2,1-3H3