2-[[(1,3-benzoxazol-2-ylamino)-morpholin-4-yl-methylidene]amino]-N-(4-cyano-1-methyl-piperidin-4-yl)-3-cyclohexyl-propanamide

Systemtic Name: 2-[[(1,3-benzoxazol-2-ylamino)-morpholin-4-yl-methylidene]amino]-N-(4-cyano-1-methyl-piperidin-4-yl)-3-cyclohexyl-propanamide Openeye Name: 2-[[(1,3-benzoxazol-2-ylamino)-morpholino-methylene]amino]-N-(4-cyano-1-methyl-4-piperidyl)-3-cyclohexyl-propanamide CAS Name: 2-[[(1,3-benzoxazol-2-ylamino)-(4-morpholinyl)methylidene]amino]-N-(4-cyano-1-methyl-4-piperidinyl)-3-cyclohexylpropanamide IUPAC Name: 2-[[(1,3-benzoxazol-2-ylamino)-morpholin-4-ylmethylidene]amino]-N-(4-cyano-1-methylpiperidin-4-yl)-3-cyclohexylpropanamide Traditional Name: 2-[[(1,3-benzoxazol-2-ylamino)-morpholino-methylene]amino]-N-(4-cyano-1-methyl-4-piperidyl)-3-cyclohexyl-propionamide Formula: C28H39N7O3 MolecularWeight: 521.65436

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCC2)N=C(NC3=NC4=CC=CC=C4O3)N5CCOCC5

Isomeric SMILES

CN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCC2)N=C(NC3=NC4=CC=CC=C4O3)N5CCOCC5

InChI

InChI=1S/C28H39N7O3/c1-34-13-11-28(20-29,12-14-34)33-25(36)23(19-21-7-3-2-4-8-21)30-26(35-15-17-37-18-16-35)32-27-31-22-9-5-6-10-24(22)38-27/h5-6,9-10,21,23H,2-4,7-8,11-19H2,1H3,(H,33,36)(H,30,31,32)