propan-2-yl 4-[2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-(2-thenoyl)piperazino]acetyl]amino]benzoic acid isopropyl ester Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C21H25N3O4S/c1-15(2)28-21(27)16-5-7-17(8-6-16)22-19(25)14-23-9-11-24(12-10-23)20(26)18-4-3-13-29-18/h3-8,13,15H,9-12,14H2,1-2H3,(H,22,25)