3-[[[4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoyl]amino]methyl]-N,N-dimethyl-benzamide

Systemtic Name: 3-[[[4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoyl]amino]methyl]-N,N-dimethyl-benzamide Openeye Name: 3-[[[4-(5-chloro-2-thienyl)-4-oxo-butanoyl]amino]methyl]-N,N-dimethyl-benzamide CAS Name: 3-[[[4-(5-chloro-2-thiophenyl)-1,4-dioxobutyl]amino]methyl]-N,N-dimethylbenzamide IUPAC Name: 3-[[[4-(5-chlorothiophen-2-yl)-4-oxobutanoyl]amino]methyl]-N,N-dimethylbenzamide Traditional Name: 3-[[[4-(5-chloro-2-thienyl)-4-keto-butanoyl]amino]methyl]-N,N-dimethyl-benzamide Formula: C18H19ClN2O3S MolecularWeight: 378.87306

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=CC=C1)CNC(=O)CCC(=O)C2=CC=C(S2)Cl

Isomeric SMILES

CN(C)C(=O)C1=CC(=CC=C1)CNC(=O)CCC(=O)C2=CC=C(S2)Cl

InChI

InChI=1S/C18H19ClN2O3S/c1-21(2)18(24)13-5-3-4-12(10-13)11-20-17(23)9-6-14(22)15-7-8-16(19)25-15/h3-5,7-8,10H,6,9,11H2,1-2H3,(H,20,23)