(4Z)-4-aminocarbonylimino-2-azanyl-2-(3-cyano-1-phenethyl-pyrrolidin-3-yl)-3-cyclohexyl-4-morpholin-4-yl-butanamide

Systemtic Name: (4Z)-4-aminocarbonylimino-2-azanyl-2-(3-cyano-1-phenethyl-pyrrolidin-3-yl)-3-cyclohexyl-4-morpholin-4-yl-butanamide Openeye Name: (4Z)-2-amino-4-carbamoylimino-2-(3-cyano-1-phenethyl-pyrrolidin-3-yl)-3-cyclohexyl-4-morpholino-butanamide CAS Name: (4Z)-2-amino-4-carbamoylimino-2-(3-cyano-1-phenethyl-3-pyrrolidinyl)-3-cyclohexyl-4-(4-morpholinyl)butanamide IUPAC Name: (4Z)-2-amino-4-carbamoylimino-2-(3-cyano-1-phenethylpyrrolidin-3-yl)-3-cyclohexyl-4-morpholin-4-ylbutanamide Traditional Name: (4Z)-2-amino-4-carbamoylimino-2-(3-cyano-1-phenethyl-pyrrolidin-3-yl)-3-cyclohexyl-4-morpholino-butyramide Formula: C28H41N7O3 MolecularWeight: 523.67024

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(=NC(=O)N)N2CCOCC2)C(C(=O)N)(C3(CCN(C3)CCC4=CC=CC=C4)C#N)N

Isomeric SMILES

C1CCC(CC1)C(/C(=N/C(=O)N)/N2CCOCC2)C(C(=O)N)(C3(CCN(C3)CCC4=CC=CC=C4)C#N)N

InChI

InChI=1S/C28H41N7O3/c29-19-27(12-14-34(20-27)13-11-21-7-3-1-4-8-21)28(32,25(30)36)23(22-9-5-2-6-10-22)24(33-26(31)37)35-15-17-38-18-16-35/h1,3-4,7-8,22-23H,2,5-6,9-18,20,32H2,(H2,30,36)(H2,31,37)/b33-24-