ethyl 2-[4-(furan-2-ylmethylcarbamoyl)-3-[(phenylmethyl)carbamoyl]piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-(furan-2-ylmethylcarbamoyl)-3-[(phenylmethyl)carbamoyl]piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[3-(benzylcarbamoyl)-4-(2-furylmethylcarbamoyl)piperazin-1-yl]acetate CAS Name: 2-[4-[(2-furanylmethylamino)-oxomethyl]-3-[oxo-[(phenylmethyl)amino]methyl]-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(benzylcarbamoyl)-4-(furan-2-ylmethylcarbamoyl)piperazin-1-yl]acetate Traditional Name: 2-[3-(benzylcarbamoyl)-4-(2-furfurylcarbamoyl)piperazino]acetic acid ethyl ester Formula: C22H28N4O5 MolecularWeight: 428.48152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(C(C1)C(=O)NCC2=CC=CC=C2)C(=O)NCC3=CC=CO3

Isomeric SMILES

CCOC(=O)CN1CCN(C(C1)C(=O)NCC2=CC=CC=C2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C22H28N4O5/c1-2-30-20(27)16-25-10-11-26(22(29)24-14-18-9-6-12-31-18)19(15-25)21(28)23-13-17-7-4-3-5-8-17/h3-9,12,19H,2,10-11,13-16H2,1H3,(H,23,28)(H,24,29)