(phenylmethyl) N-[1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[2-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-1-methyl-2-oxo-ethyl]carbamate CAS Name: N-[1-[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[2-(1,3-benzothiazol-2-yl)pyrrolidino]-2-keto-1-methyl-ethyl]carbamic acid benzyl ester Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C2=NC3=CC=CC=C3S2)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N1CCCC1C2=NC3=CC=CC=C3S2)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C22H23N3O3S/c1-15(23-22(27)28-14-16-8-3-2-4-9-16)21(26)25-13-7-11-18(25)20-24-17-10-5-6-12-19(17)29-20/h2-6,8-10,12,15,18H,7,11,13-14H2,1H3,(H,23,27)