(phenylmethyl) N-[2-[4-(2-dimethylaminoethyloxy)piperidin-1-yl]-2-oxidanylidene-1-propan-2-ylsulfanyl-ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-[4-(2-dimethylaminoethyloxy)piperidin-1-yl]-2-oxidanylidene-1-propan-2-ylsulfanyl-ethyl]carbamate Openeye Name: benzyl N-[2-[4-(2-dimethylaminoethyloxy)-1-piperidyl]-1-isopropylsulfanyl-2-oxo-ethyl]carbamate CAS Name: N-[2-[4-(2-dimethylaminoethyloxy)-1-piperidinyl]-2-oxo-1-(propan-2-ylthio)ethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-[4-(2-dimethylaminoethyloxy)piperidin-1-yl]-2-oxo-1-propan-2-ylsulfanylethyl]carbamate Traditional Name: N-[2-[4-(2-dimethylaminoethyloxy)piperidino]-1-(isopropylthio)-2-keto-ethyl]carbamic acid benzyl ester Formula: C22H35N3O4S MolecularWeight: 437.596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC(C(=O)N1CCC(CC1)OCCN(C)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)SC(C(=O)N1CCC(CC1)OCCN(C)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H35N3O4S/c1-17(2)30-20(23-22(27)29-16-18-8-6-5-7-9-18)21(26)25-12-10-19(11-13-25)28-15-14-24(3)4/h5-9,17,19-20H,10-16H2,1-4H3,(H,23,27)