methyl 2-[2-(5,6,7,8-tetrahydroquinolin-8-ylsulfanyl)-1,3-benzoxazol-5-yl]ethanoate

Systemtic Name: methyl 2-[2-(5,6,7,8-tetrahydroquinolin-8-ylsulfanyl)-1,3-benzoxazol-5-yl]ethanoate Openeye Name: methyl 2-[2-(5,6,7,8-tetrahydroquinolin-8-ylsulfanyl)-1,3-benzoxazol-5-yl]acetate CAS Name: 2-[2-(5,6,7,8-tetrahydroquinolin-8-ylthio)-1,3-benzoxazol-5-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(5,6,7,8-tetrahydroquinolin-8-ylsulfanyl)-1,3-benzoxazol-5-yl]acetate Traditional Name: 2-[2-(5,6,7,8-tetrahydroquinolin-8-ylthio)-1,3-benzoxazol-5-yl]acetic acid methyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC2=C(C=C1)OC(=N2)SC3CCCC4=C3N=CC=C4

Isomeric SMILES

COC(=O)CC1=CC2=C(C=C1)OC(=N2)SC3CCCC4=C3N=CC=C4

InChI

InChI=1S/C19H18N2O3S/c1-23-17(22)11-12-7-8-15-14(10-12)21-19(24-15)25-16-6-2-4-13-5-3-9-20-18(13)16/h3,5,7-10,16H,2,4,6,11H2,1H3