tert-butyl N-[4-cyclohexyl-1-[[1-(phenylmethyl)piperidin-4-yl]amino]-1-sulfanylidene-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-cyclohexyl-1-[[1-(phenylmethyl)piperidin-4-yl]amino]-1-sulfanylidene-butan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[(1-benzyl-4-piperidyl)carbamothioyl]-3-cyclohexyl-propyl]carbamate CAS Name: N-[4-cyclohexyl-1-[[1-(phenylmethyl)-4-piperidinyl]amino]-1-sulfanylidenebutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[(1-benzylpiperidin-4-yl)amino]-4-cyclohexyl-1-sulfanylidenebutan-2-yl]carbamate Traditional Name: N-[1-[(1-benzyl-4-piperidyl)thiocarbamoyl]-3-cyclohexyl-propyl]carbamic acid tert-butyl ester Formula: C27H43N3O2S MolecularWeight: 473.71422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC1CCCCC1)C(=S)NC2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCC1CCCCC1)C(=S)NC2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C27H43N3O2S/c1-27(2,3)32-26(31)29-24(15-14-21-10-6-4-7-11-21)25(33)28-23-16-18-30(19-17-23)20-22-12-8-5-9-13-22/h5,8-9,12-13,21,23-24H,4,6-7,10-11,14-20H2,1-3H3,(H,28,33)(H,29,31)