N-(4-methoxyphenyl)-2-(4-methylquinolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(4-methoxyphenyl)-2-(4-methylquinolin-2-yl)sulfanyl-butanamide Openeye Name: N-(4-methoxyphenyl)-2-[(4-methyl-2-quinolyl)sulfanyl]butanamide CAS Name: N-(4-methoxyphenyl)-2-[(4-methyl-2-quinolinyl)thio]butanamide IUPAC Name: N-(4-methoxyphenyl)-2-(4-methylquinolin-2-yl)sulfanylbutanamide Traditional Name: N-(4-methoxyphenyl)-2-[(4-methyl-2-quinolyl)thio]butyramide Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)OC)SC2=NC3=CC=CC=C3C(=C2)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)OC)SC2=NC3=CC=CC=C3C(=C2)C

InChI

InChI=1S/C21H22N2O2S/c1-4-19(21(24)22-15-9-11-16(25-3)12-10-15)26-20-13-14(2)17-7-5-6-8-18(17)23-20/h5-13,19H,4H2,1-3H3,(H,22,24)