4-[2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 4-[2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylethanoylamino]-N,N-diethyl-benzamide Openeye Name: 4-[[2-(1-amino-4-phenyl-imidazol-2-yl)sulfanylacetyl]amino]-N,N-diethyl-benzamide CAS Name: 4-[[2-[(1-amino-4-phenyl-2-imidazolyl)thio]-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 4-[[2-(1-amino-4-phenylimidazol-2-yl)sulfanylacetyl]amino]-N,N-diethylbenzamide Traditional Name: 4-[[2-[(1-amino-4-phenyl-imidazol-2-yl)thio]acetyl]amino]-N,N-diethyl-benzamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=CN2N)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=CN2N)C3=CC=CC=C3

InChI

InChI=1S/C22H25N5O2S/c1-3-26(4-2)21(29)17-10-12-18(13-11-17)24-20(28)15-30-22-25-19(14-27(22)23)16-8-6-5-7-9-16/h5-14H,3-4,15,23H2,1-2H3,(H,24,28)