N-(2-azanyl-2-oxidanylidene-ethyl)-3-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-3-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylamino]benzamide Openeye Name: N-(2-amino-2-oxo-ethyl)-3-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]benzamide CAS Name: N-(2-amino-2-oxoethyl)-3-[[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-(2-amino-2-oxoethyl)-3-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: N-(2-amino-2-keto-ethyl)-3-[[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]amino]benzamide Formula: C17H19N5O3S MolecularWeight: 373.42946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=CC(=C2)C(=O)NCC(=O)N)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=CC(=C2)C(=O)NCC(=O)N)C

InChI

InChI=1S/C17H19N5O3S/c1-10-6-11(2)21-17(20-10)26-9-15(24)22-13-5-3-4-12(7-13)16(25)19-8-14(18)23/h3-7H,8-9H2,1-2H3,(H2,18,23)(H,19,25)(H,22,24)