2,2-dimethylpropyl N-[[1-[(4-cyano-1-propyl-piperidin-4-yl)amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]carbamothioyl]carbamate

Systemtic Name: 2,2-dimethylpropyl N-[[1-[(4-cyano-1-propyl-piperidin-4-yl)amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]carbamothioyl]carbamate Openeye Name: 2,2-dimethylpropyl N-[[2-[(4-cyano-1-propyl-4-piperidyl)amino]-1-(cyclohexylmethyl)-2-oxo-ethyl]carbamothioyl]carbamate CAS Name: N-[[[1-[(4-cyano-1-propyl-4-piperidinyl)amino]-3-cyclohexyl-1-oxopropan-2-yl]amino]-sulfanylidenemethyl]carbamic acid 2,2-dimethylpropyl ester IUPAC Name: 2,2-dimethylpropyl N-[[1-[(4-cyano-1-propylpiperidin-4-yl)amino]-3-cyclohexyl-1-oxopropan-2-yl]carbamothioyl]carbamate Traditional Name: N-[[2-[(4-cyano-1-propyl-4-piperidyl)amino]-1-(cyclohexylmethyl)-2-keto-ethyl]thiocarbamoyl]carbamic acid neopentyl ester Formula: C25H43N5O3S MolecularWeight: 493.70562

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCC2)NC(=S)NC(=O)OCC(C)(C)C

Isomeric SMILES

CCCN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCC2)NC(=S)NC(=O)OCC(C)(C)C

InChI

InChI=1S/C25H43N5O3S/c1-5-13-30-14-11-25(17-26,12-15-30)29-21(31)20(16-19-9-7-6-8-10-19)27-22(34)28-23(32)33-18-24(2,3)4/h19-20H,5-16,18H2,1-4H3,(H,29,31)(H2,27,28,32,34)