2-chloranyl-N-[1-[2-(3,4-diethoxyphenyl)ethylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[1-[2-(3,4-diethoxyphenyl)ethylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-chloro-N-[1-[2-(3,4-diethoxyphenyl)ethylcarbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-chloro-N-[1-[2-(3,4-diethoxyphenyl)ethylamino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-chloro-N-[1-[2-(3,4-diethoxyphenyl)ethylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-chloro-N-[1-[2-(3,4-diethoxyphenyl)ethylcarbamoyl]-3-(methylthio)propyl]benzamide Formula: C24H31ClN2O4S MolecularWeight: 479.03194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Cl)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Cl)OCC

InChI

InChI=1S/C24H31ClN2O4S/c1-4-30-21-11-10-17(16-22(21)31-5-2)12-14-26-24(29)20(13-15-32-3)27-23(28)18-8-6-7-9-19(18)25/h6-11,16,20H,4-5,12-15H2,1-3H3,(H,26,29)(H,27,28)