S-[2-(2,2-diphenylethanoylamino)ethyl] 2-azanyl-2-cyclopropyl-2-(1-ethanoylpiperidin-4-yl)ethanethioate

Systemtic Name: S-[2-(2,2-diphenylethanoylamino)ethyl] 2-azanyl-2-cyclopropyl-2-(1-ethanoylpiperidin-4-yl)ethanethioate Openeye Name: S-[2-[(2,2-diphenylacetyl)amino]ethyl] 2-(1-acetyl-4-piperidyl)-2-amino-2-cyclopropyl-ethanethioate CAS Name: 2-(1-acetyl-4-piperidinyl)-2-amino-2-cyclopropylethanethioic acid S-[2-[(1-oxo-2,2-diphenylethyl)amino]ethyl] ester IUPAC Name: S-[2-[(2,2-diphenylacetyl)amino]ethyl] 2-(1-acetylpiperidin-4-yl)-2-amino-2-cyclopropylethanethioate Traditional Name: 2-(1-acetyl-4-piperidyl)-2-amino-2-cyclopropyl-ethanethioic acid S-[2-[(2,2-diphenylacetyl)amino]ethyl] ester Formula: C28H35N3O3S MolecularWeight: 493.6608

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C(C2CC2)(C(=O)SCCNC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)N

Isomeric SMILES

CC(=O)N1CCC(CC1)C(C2CC2)(C(=O)SCCNC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C28H35N3O3S/c1-20(32)31-17-14-24(15-18-31)28(29,23-12-13-23)27(34)35-19-16-30-26(33)25(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-11,23-25H,12-19,29H2,1H3,(H,30,33)