ethyl 5,5-dimethyl-2-(phenylcarbonylcarbamothioylamino)-4,7-dihydrothieno[2,3-c]thiopyran-3-carboxylate

Systemtic Name: ethyl 5,5-dimethyl-2-(phenylcarbonylcarbamothioylamino)-4,7-dihydrothieno[2,3-c]thiopyran-3-carboxylate Openeye Name: ethyl 2-(benzoylcarbamothioylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-3-carboxylate CAS Name: 2-[[benzamido(sulfanylidene)methyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(benzoylcarbamothioylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-3-carboxylate Traditional Name: 2-(benzoylthiocarbamoylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-3-carboxylic acid ethyl ester Formula: C20H22N2O3S3 MolecularWeight: 434.59528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CC(SC2)(C)C)NC(=S)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CC(SC2)(C)C)NC(=S)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O3S3/c1-4-25-18(24)15-13-10-20(2,3)27-11-14(13)28-17(15)22-19(26)21-16(23)12-8-6-5-7-9-12/h5-9H,4,10-11H2,1-3H3,(H2,21,22,23,26)