(phenylmethyl) N-[2-[4-(3-hydroxyphenyl)piperazin-1-yl]-2-oxidanylidene-1-propan-2-ylsulfanyl-ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-[4-(3-hydroxyphenyl)piperazin-1-yl]-2-oxidanylidene-1-propan-2-ylsulfanyl-ethyl]carbamate Openeye Name: benzyl N-[2-[4-(3-hydroxyphenyl)piperazin-1-yl]-1-isopropylsulfanyl-2-oxo-ethyl]carbamate CAS Name: N-[2-[4-(3-hydroxyphenyl)-1-piperazinyl]-2-oxo-1-(propan-2-ylthio)ethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-[4-(3-hydroxyphenyl)piperazin-1-yl]-2-oxo-1-propan-2-ylsulfanylethyl]carbamate Traditional Name: N-[2-[4-(3-hydroxyphenyl)piperazino]-1-(isopropylthio)-2-keto-ethyl]carbamic acid benzyl ester Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC(C(=O)N1CCN(CC1)C2=CC(=CC=C2)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)SC(C(=O)N1CCN(CC1)C2=CC(=CC=C2)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O4S/c1-17(2)31-21(24-23(29)30-16-18-7-4-3-5-8-18)22(28)26-13-11-25(12-14-26)19-9-6-10-20(27)15-19/h3-10,15,17,21,27H,11-14,16H2,1-2H3,(H,24,29)