methyl 3-[[4-(4-ethanoylphenyl)piperazin-1-yl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-(4-ethanoylphenyl)piperazin-1-yl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[4-(4-acetylphenyl)piperazine-1-carbonyl]amino]thiophene-2-carboxylate CAS Name: 3-[[[4-(4-acetylphenyl)-1-piperazinyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-(4-acetylphenyl)piperazine-1-carbonyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[4-(4-acetylphenyl)piperazine-1-carbonyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)NC3=C(SC=C3)C(=O)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)NC3=C(SC=C3)C(=O)OC

InChI

InChI=1S/C19H21N3O4S/c1-13(23)14-3-5-15(6-4-14)21-8-10-22(11-9-21)19(25)20-16-7-12-27-17(16)18(24)26-2/h3-7,12H,8-11H2,1-2H3,(H,20,25)