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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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