methyl 7-[3-[3-methoxy-4-(2-methylsulfanyl-1,3-thiazol-4-yl)-2-propyl-phenoxy]propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylate

Systemtic Name: methyl 7-[3-[3-methoxy-4-(2-methylsulfanyl-1,3-thiazol-4-yl)-2-propyl-phenoxy]propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylate Openeye Name: methyl 7-[3-[3-methoxy-4-(2-methylsulfanylthiazol-4-yl)-2-propyl-phenoxy]propoxy]-8-propyl-chromane-2-carboxylate CAS Name: 7-[3-[3-methoxy-4-[2-(methylthio)-4-thiazolyl]-2-propylphenoxy]propoxy]-8-propyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid methyl ester IUPAC Name: methyl 7-[3-[3-methoxy-4-(2-methylsulfanyl-1,3-thiazol-4-yl)-2-propylphenoxy]propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylate Traditional Name: 7-[3-[3-methoxy-4-[2-(methylthio)thiazol-4-yl]-2-propyl-phenoxy]propoxy]-8-propyl-chroman-2-carboxylic acid methyl ester Formula: C31H39NO6S2 MolecularWeight: 585.77446

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(CC2)C(=O)OC)OCCCOC3=C(C(=C(C=C3)C4=CSC(=N4)SC)OC)CCC

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(CC2)C(=O)OC)OCCCOC3=C(C(=C(C=C3)C4=CSC(=N4)SC)OC)CCC

InChI

InChI=1S/C31H39NO6S2/c1-6-9-22-25(14-11-20-12-15-27(30(33)35-4)38-28(20)22)36-17-8-18-37-26-16-13-21(24-19-40-31(32-24)39-5)29(34-3)23(26)10-7-2/h11,13-14,16,19,27H,6-10,12,15,17-18H2,1-5H3