methyl 4-[8-[1-methoxy-3-(2-morpholin-4-ylethanoylamino)-1-oxidanylidene-propan-2-yl]naphthalen-2-yl]sulfanylbutanoate

Systemtic Name: methyl 4-[8-[1-methoxy-3-(2-morpholin-4-ylethanoylamino)-1-oxidanylidene-propan-2-yl]naphthalen-2-yl]sulfanylbutanoate Openeye Name: methyl 4-[[8-[2-methoxy-1-[[(2-morpholinoacetyl)amino]methyl]-2-oxo-ethyl]-2-naphthyl]sulfanyl]butanoate CAS Name: 4-[[8-[1-methoxy-3-[[2-(4-morpholinyl)-1-oxoethyl]amino]-1-oxopropan-2-yl]-2-naphthalenyl]thio]butanoic acid methyl ester IUPAC Name: methyl 4-[8-[1-methoxy-3-[(2-morpholin-4-ylacetyl)amino]-1-oxopropan-2-yl]naphthalen-2-yl]sulfanylbutanoate Traditional Name: 4-[[8-[2-keto-2-methoxy-1-[[(2-morpholinoacetyl)amino]methyl]ethyl]-2-naphthyl]thio]butyric acid methyl ester Formula: C25H32N2O6S MolecularWeight: 488.59638

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCSC1=CC2=C(C=CC=C2C(CNC(=O)CN3CCOCC3)C(=O)OC)C=C1

Isomeric SMILES

COC(=O)CCCSC1=CC2=C(C=CC=C2C(CNC(=O)CN3CCOCC3)C(=O)OC)C=C1

InChI

InChI=1S/C25H32N2O6S/c1-31-24(29)7-4-14-34-19-9-8-18-5-3-6-20(21(18)15-19)22(25(30)32-2)16-26-23(28)17-27-10-12-33-13-11-27/h3,5-6,8-9,15,22H,4,7,10-14,16-17H2,1-2H3,(H,26,28)