ethyl 4-(6-methyl-4-oxidanylidene-thiochromen-3-yl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(6-methyl-4-oxidanylidene-thiochromen-3-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-(6-methyl-4-oxo-thiochromen-3-yl)piperazine-1-carboxylate CAS Name: 4-(6-methyl-4-oxo-1-benzothiopyran-3-yl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(6-methyl-4-oxothiochromen-3-yl)piperazine-1-carboxylate Traditional Name: 4-(4-keto-6-methyl-thiochromen-3-yl)piperazine-1-carboxylic acid ethyl ester Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=CSC3=C(C2=O)C=C(C=C3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=CSC3=C(C2=O)C=C(C=C3)C

InChI

InChI=1S/C17H20N2O3S/c1-3-22-17(21)19-8-6-18(7-9-19)14-11-23-15-5-4-12(2)10-13(15)16(14)20/h4-5,10-11H,3,6-9H2,1-2H3