2-[(1-ethanoyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl-methyl-amino]-N-(3-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[(1-ethanoyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl-methyl-amino]-N-(3-methylsulfanylphenyl)ethanamide Openeye Name: 2-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl-methyl-amino]-N-(3-methylsulfanylphenyl)acetamide CAS Name: 2-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl-methylamino]-N-[3-(methylthio)phenyl]acetamide IUPAC Name: 2-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl-methylamino]-N-(3-methylsulfanylphenyl)acetamide Traditional Name: 2-[(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl-methyl-amino]-N-[3-(methylthio)phenyl]acetamide Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N(C)CC(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N(C)CC(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C21H25N3O4S2/c1-15(25)24-11-5-6-16-12-19(9-10-20(16)24)30(27,28)23(2)14-21(26)22-17-7-4-8-18(13-17)29-3/h4,7-10,12-13H,5-6,11,14H2,1-3H3,(H,22,26)