diethyl 5-(1,3-benzothiazol-2-ylamino)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-(1,3-benzothiazol-2-ylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-(1,3-benzothiazol-2-ylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-(1,3-benzothiazol-2-ylamino)-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(1,3-benzothiazol-2-ylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(1,3-benzothiazol-2-ylamino)-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H18N2O4S2/c1-4-23-16(21)13-10(3)14(17(22)24-5-2)26-15(13)20-18-19-11-8-6-7-9-12(11)25-18/h6-9H,4-5H2,1-3H3,(H,19,20)