6-[4-(3,4-dimethoxyphenyl)sulfanylbutoxy]-3,4-dihydro-1H-quinolin-2-one

Systemtic Name: 6-[4-(3,4-dimethoxyphenyl)sulfanylbutoxy]-3,4-dihydro-1H-quinolin-2-one Openeye Name: 6-[4-(3,4-dimethoxyphenyl)sulfanylbutoxy]-3,4-dihydro-1H-quinolin-2-one CAS Name: 6-[4-[(3,4-dimethoxyphenyl)thio]butoxy]-3,4-dihydro-1H-quinolin-2-one IUPAC Name: 6-[4-(3,4-dimethoxyphenyl)sulfanylbutoxy]-3,4-dihydro-1H-quinolin-2-one Traditional Name: 6-[4-[(3,4-dimethoxyphenyl)thio]butoxy]-3,4-dihydrocarbostyril Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCCCCOC2=CC3=C(C=C2)NC(=O)CC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCCCCOC2=CC3=C(C=C2)NC(=O)CC3)OC

InChI

InChI=1S/C21H25NO4S/c1-24-19-9-7-17(14-20(19)25-2)27-12-4-3-11-26-16-6-8-18-15(13-16)5-10-21(23)22-18/h6-9,13-14H,3-5,10-12H2,1-2H3,(H,22,23)