ethyl 2-[[(E)-(4-tert-butylphenyl)methylideneamino]carbamoylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-(4-tert-butylphenyl)methylideneamino]carbamoylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[[(E)-(4-tert-butylphenyl)methyleneamino]carbamoylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[[(2E)-2-[(4-tert-butylphenyl)methylidene]hydrazinyl]-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[[(E)-(4-tert-butylphenyl)methylideneamino]carbamoylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[[(E)-(4-tert-butylbenzylidene)amino]carbamoylamino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)N/N=C/C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H27N3O4S/c1-7-29-20(27)17-13(2)18(14(3)26)30-19(17)24-21(28)25-23-12-15-8-10-16(11-9-15)22(4,5)6/h8-12H,7H2,1-6H3,(H2,24,25,28)/b23-12+