ethyl 5,5-dimethyl-2-[(phenylmethyl)carbamothioylamino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate

Systemtic Name: ethyl 5,5-dimethyl-2-[(phenylmethyl)carbamothioylamino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate Openeye Name: ethyl 2-(benzylcarbamothioylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate CAS Name: 5,5-dimethyl-2-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(benzylcarbamothioylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate Traditional Name: 2-(benzylthiocarbamoylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid ethyl ester Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CC(OC2)(C)C)NC(=S)NCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CC(OC2)(C)C)NC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O3S2/c1-4-24-18(23)16-14-10-20(2,3)25-12-15(14)27-17(16)22-19(26)21-11-13-8-6-5-7-9-13/h5-9H,4,10-12H2,1-3H3,(H2,21,22,26)