[[[1-[(4-cyano-1-methyl-piperidin-4-yl)amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]amino]-piperidin-1-yl-methyl]carbamic acid

Systemtic Name: [[[1-[(4-cyano-1-methyl-piperidin-4-yl)amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]amino]-piperidin-1-yl-methyl]carbamic acid Openeye Name: [[[2-[(4-cyano-1-methyl-4-piperidyl)amino]-1-(cyclohexylmethyl)-2-oxo-ethyl]amino]-(1-piperidyl)methyl]carbamic acid CAS Name: [[[1-[(4-cyano-1-methyl-4-piperidinyl)amino]-3-cyclohexyl-1-oxopropan-2-yl]amino]-(1-piperidinyl)methyl]carbamic acid IUPAC Name: [[[1-[(4-cyano-1-methylpiperidin-4-yl)amino]-3-cyclohexyl-1-oxopropan-2-yl]amino]-piperidin-1-ylmethyl]carbamic acid Traditional Name: [[[2-[(4-cyano-1-methyl-4-piperidyl)amino]-1-(cyclohexylmethyl)-2-keto-ethyl]amino]-piperidino-methyl]carbamic acid Formula: C23H40N6O3 MolecularWeight: 448.6021

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCC2)NC(NC(=O)O)N3CCCCC3

Isomeric SMILES

CN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCC2)NC(NC(=O)O)N3CCCCC3

InChI

InChI=1S/C23H40N6O3/c1-28-14-10-23(17-24,11-15-28)27-20(30)19(16-18-8-4-2-5-9-18)25-21(26-22(31)32)29-12-6-3-7-13-29/h18-19,21,25-26H,2-16H2,1H3,(H,27,30)(H,31,32)