N-(3-cyano-1-pentan-3-yl-pyrrolidin-3-yl)-3-cyclohexyl-2-[[(ethylcarbamoylamino)-morpholin-4-yl-methylidene]amino]propanamide

Systemtic Name: N-(3-cyano-1-pentan-3-yl-pyrrolidin-3-yl)-3-cyclohexyl-2-[[(ethylcarbamoylamino)-morpholin-4-yl-methylidene]amino]propanamide Openeye Name: N-[3-cyano-1-(1-ethylpropyl)pyrrolidin-3-yl]-3-cyclohexyl-2-[[(ethylcarbamoylamino)-morpholino-methylene]amino]propanamide CAS Name: N-(3-cyano-1-pentan-3-yl-3-pyrrolidinyl)-3-cyclohexyl-2-[[(ethylcarbamoylamino)-(4-morpholinyl)methylidene]amino]propanamide IUPAC Name: N-(3-cyano-1-pentan-3-ylpyrrolidin-3-yl)-3-cyclohexyl-2-[[(ethylcarbamoylamino)-morpholin-4-ylmethylidene]amino]propanamide Traditional Name: N-[3-cyano-1-(1-ethylpropyl)pyrrolidin-3-yl]-3-cyclohexyl-2-[[(ethylcarbamoylamino)-morpholino-methylene]amino]propionamide Formula: C27H47N7O3 MolecularWeight: 517.70718

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1CCC(C1)(C#N)NC(=O)C(CC2CCCCC2)N=C(NC(=O)NCC)N3CCOCC3

Isomeric SMILES

CCC(CC)N1CCC(C1)(C#N)NC(=O)C(CC2CCCCC2)N=C(NC(=O)NCC)N3CCOCC3

InChI

InChI=1S/C27H47N7O3/c1-4-22(5-2)34-13-12-27(19-28,20-34)32-24(35)23(18-21-10-8-7-9-11-21)30-25(31-26(36)29-6-3)33-14-16-37-17-15-33/h21-23H,4-18,20H2,1-3H3,(H,32,35)(H2,29,30,31,36)