2-(dimethylamino)-N-(3-methoxypropyl)-5-[(4-methylsulfanylphenyl)carbamoylamino]benzamide

Systemtic Name: 2-(dimethylamino)-N-(3-methoxypropyl)-5-[(4-methylsulfanylphenyl)carbamoylamino]benzamide Openeye Name: 2-(dimethylamino)-N-(3-methoxypropyl)-5-[(4-methylsulfanylphenyl)carbamoylamino]benzamide CAS Name: 2-(dimethylamino)-N-(3-methoxypropyl)-5-[[[4-(methylthio)anilino]-oxomethyl]amino]benzamide IUPAC Name: 2-(dimethylamino)-N-(3-methoxypropyl)-5-[(4-methylsulfanylphenyl)carbamoylamino]benzamide Traditional Name: 2-(dimethylamino)-N-(3-methoxypropyl)-5-[[4-(methylthio)phenyl]carbamoylamino]benzamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)NC(=O)NC2=CC=C(C=C2)SC)C(=O)NCCCOC

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)NC(=O)NC2=CC=C(C=C2)SC)C(=O)NCCCOC

InChI

InChI=1S/C21H28N4O3S/c1-25(2)19-11-8-16(14-18(19)20(26)22-12-5-13-28-3)24-21(27)23-15-6-9-17(29-4)10-7-15/h6-11,14H,5,12-13H2,1-4H3,(H,22,26)(H2,23,24,27)