(phenylmethyl) 4-[[4-(1,2,3-thiadiazol-4-yl)phenyl]methylcarbamoyl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[[4-(1,2,3-thiadiazol-4-yl)phenyl]methylcarbamoyl]piperazine-1-carboxylate Openeye Name: benzyl 4-[[4-(thiadiazol-4-yl)phenyl]methylcarbamoyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[[4-(4-thiadiazolyl)phenyl]methylamino]methyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[4-(thiadiazol-4-yl)phenyl]methylcarbamoyl]piperazine-1-carboxylate Traditional Name: 4-[[4-(thiadiazol-4-yl)benzyl]carbamoyl]piperazine-1-carboxylic acid benzyl ester Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCC2=CC=C(C=C2)C3=CSN=N3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)NCC2=CC=C(C=C2)C3=CSN=N3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C22H23N5O3S/c28-21(23-14-17-6-8-19(9-7-17)20-16-31-25-24-20)26-10-12-27(13-11-26)22(29)30-15-18-4-2-1-3-5-18/h1-9,16H,10-15H2,(H,23,28)