(phenylmethyl) 4-[[propan-2-yl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)carbamoyl]amino]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[[propan-2-yl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)carbamoyl]amino]piperidine-1-carboxylate Openeye Name: benzyl 4-[[isopropyl-(2-thioxo-3H-1,3-benzothiazol-6-yl)carbamoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[oxo-[propan-2-yl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]methyl]amino]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[propan-2-yl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)carbamoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[isopropyl-(2-thioxo-3H-1,3-benzothiazol-6-yl)carbamoyl]amino]piperidine-1-carboxylic acid benzyl ester Formula: C24H28N4O3S2 MolecularWeight: 484.63412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC2=C(C=C1)NC(=S)S2)C(=O)NC3CCN(CC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)N(C1=CC2=C(C=C1)NC(=S)S2)C(=O)NC3CCN(CC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O3S2/c1-16(2)28(19-8-9-20-21(14-19)33-23(32)26-20)22(29)25-18-10-12-27(13-11-18)24(30)31-15-17-6-4-3-5-7-17/h3-9,14,16,18H,10-13,15H2,1-2H3,(H,25,29)(H,26,32)