N-[3-cyano-1-(thian-4-yl)pyrrolidin-3-yl]-2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxidanylidene-butanamide

Systemtic Name: N-[3-cyano-1-(thian-4-yl)pyrrolidin-3-yl]-2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxidanylidene-butanamide Openeye Name: N-(3-cyano-1-tetrahydrothiopyran-4-yl-pyrrolidin-3-yl)-2-(cyclohexylmethyl)-4-morpholino-4-oxo-butanamide CAS Name: N-[3-cyano-1-(4-thianyl)-3-pyrrolidinyl]-2-(cyclohexylmethyl)-4-(4-morpholinyl)-4-oxobutanamide IUPAC Name: N-[3-cyano-1-(thian-4-yl)pyrrolidin-3-yl]-2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxobutanamide Traditional Name: N-(3-cyano-1-tetrahydrothiopyran-4-yl-pyrrolidin-3-yl)-2-(cyclohexylmethyl)-4-keto-4-morpholino-butyramide Formula: C25H40N4O3S MolecularWeight: 476.6751

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(CC(=O)N2CCOCC2)C(=O)NC3(CCN(C3)C4CCSCC4)C#N

Isomeric SMILES

C1CCC(CC1)CC(CC(=O)N2CCOCC2)C(=O)NC3(CCN(C3)C4CCSCC4)C#N

InChI

InChI=1S/C25H40N4O3S/c26-18-25(8-9-29(19-25)22-6-14-33-15-7-22)27-24(31)21(16-20-4-2-1-3-5-20)17-23(30)28-10-12-32-13-11-28/h20-22H,1-17,19H2,(H,27,31)