4-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylpropanoylamino]-N-methyl-benzamide

Systemtic Name: 4-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylpropanoylamino]-N-methyl-benzamide Openeye Name: 4-[3-(2-amino-2-oxo-ethyl)sulfanylpropanoylamino]-N-methyl-benzamide CAS Name: 4-[[3-[(2-amino-2-oxoethyl)thio]-1-oxopropyl]amino]-N-methylbenzamide IUPAC Name: 4-[3-(2-amino-2-oxoethyl)sulfanylpropanoylamino]-N-methylbenzamide Traditional Name: 4-[3-[(2-amino-2-keto-ethyl)thio]propanoylamino]-N-methyl-benzamide Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)CCSCC(=O)N

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)CCSCC(=O)N

InChI

InChI=1S/C13H17N3O3S/c1-15-13(19)9-2-4-10(5-3-9)16-12(18)6-7-20-8-11(14)17/h2-5H,6-8H2,1H3,(H2,14,17)(H,15,19)(H,16,18)