tert-butyl 4-(1,3-benzothiazol-2-ylmethylcarbamoyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(1,3-benzothiazol-2-ylmethylcarbamoyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(1,3-benzothiazol-2-ylmethylcarbamoyl)piperazine-1-carboxylate CAS Name: 4-[(1,3-benzothiazol-2-ylmethylamino)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1,3-benzothiazol-2-ylmethylcarbamoyl)piperazine-1-carboxylate Traditional Name: 4-(1,3-benzothiazol-2-ylmethylcarbamoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C18H24N4O3S MolecularWeight: 376.47316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)NCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)NCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H24N4O3S/c1-18(2,3)25-17(24)22-10-8-21(9-11-22)16(23)19-12-15-20-13-6-4-5-7-14(13)26-15/h4-7H,8-12H2,1-3H3,(H,19,23)