4-[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 4-[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylethanoylamino]-N,N-diethyl-benzamide Openeye Name: 4-[[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylacetyl]amino]-N,N-diethyl-benzamide CAS Name: 4-[[2-[[1-(3-chlorophenyl)-2-imidazolyl]thio]-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 4-[[2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylacetyl]amino]-N,N-diethylbenzamide Traditional Name: 4-[[2-[[1-(3-chlorophenyl)imidazol-2-yl]thio]acetyl]amino]-N,N-diethyl-benzamide Formula: C22H23ClN4O2S MolecularWeight: 442.96162

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=CN2C3=CC(=CC=C3)Cl

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=CN2C3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H23ClN4O2S/c1-3-26(4-2)21(29)16-8-10-18(11-9-16)25-20(28)15-30-22-24-12-13-27(22)19-7-5-6-17(23)14-19/h5-14H,3-4,15H2,1-2H3,(H,25,28)