diethyl 3-methyl-5-[[(4-propan-2-ylphenyl)methylideneamino]carbamoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[[(4-propan-2-ylphenyl)methylideneamino]carbamoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[[(4-isopropylphenyl)methyleneamino]carbamoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo-[2-[(4-propan-2-ylphenyl)methylidene]hydrazinyl]methyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[(4-propan-2-ylphenyl)methylideneamino]carbamoylamino]thiophene-2,4-dicarboxylate Traditional Name: 5-[[(4-isopropylbenzylidene)amino]carbamoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)NN=CC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)NN=CC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C22H27N3O5S/c1-6-29-20(26)17-14(5)18(21(27)30-7-2)31-19(17)24-22(28)25-23-12-15-8-10-16(11-9-15)13(3)4/h8-13H,6-7H2,1-5H3,(H2,24,25,28)