butyl N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)carbamate

Systemtic Name: butyl N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)carbamate Openeye Name: butyl N-(4-cyano-7-methyl-1-thioxo-5,6,7,8-tetrahydroisothiochromen-3-yl)carbamate CAS Name: N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydro-2-benzothiopyran-3-yl)carbamic acid butyl ester IUPAC Name: butyl N-(4-cyano-7-methyl-1-sulfanylidene-5,6,7,8-tetrahydroisothiochromen-3-yl)carbamate Traditional Name: N-(4-cyano-7-methyl-1-thioxo-5,6,7,8-tetrahydroisothiochromen-3-yl)carbamic acid butyl ester Formula: C16H20N2O2S2 MolecularWeight: 336.4722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC1=C(C2=C(CC(CC2)C)C(=S)S1)C#N

Isomeric SMILES

CCCCOC(=O)NC1=C(C2=C(CC(CC2)C)C(=S)S1)C#N

InChI

InChI=1S/C16H20N2O2S2/c1-3-4-7-20-16(19)18-14-13(9-17)11-6-5-10(2)8-12(11)15(21)22-14/h10H,3-8H2,1-2H3,(H,18,19)