3-(3-methylbutylamino)-2-oxidanyl-2-(1-phenylbutan-2-yl)thiolane-3-carboxamide

Systemtic Name: 3-(3-methylbutylamino)-2-oxidanyl-2-(1-phenylbutan-2-yl)thiolane-3-carboxamide Openeye Name: 2-(1-benzylpropyl)-2-hydroxy-3-(isopentylamino)tetrahydrothiophene-3-carboxamide CAS Name: 2-hydroxy-3-(3-methylbutylamino)-2-(1-phenylbutan-2-yl)-3-thiolanecarboxamide IUPAC Name: 2-hydroxy-3-(3-methylbutylamino)-2-(1-phenylbutan-2-yl)thiolane-3-carboxamide Traditional Name: 2-(1-benzylpropyl)-2-hydroxy-3-(isoamylamino)tetrahydrothiophene-3-carboxamide Formula: C20H32N2O2S MolecularWeight: 364.54528

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)C2(C(CCS2)(C(=O)N)NCCC(C)C)O

Isomeric SMILES

CCC(CC1=CC=CC=C1)C2(C(CCS2)(C(=O)N)NCCC(C)C)O

InChI

InChI=1S/C20H32N2O2S/c1-4-17(14-16-8-6-5-7-9-16)20(24)19(18(21)23,11-13-25-20)22-12-10-15(2)3/h5-9,15,17,22,24H,4,10-14H2,1-3H3,(H2,21,23)