4-[3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoylamino]-N-methyl-benzamide

Systemtic Name: 4-[3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoylamino]-N-methyl-benzamide Openeye Name: 4-[3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoylamino]-N-methyl-benzamide CAS Name: 4-[[3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-1-oxopropyl]amino]-N-methylbenzamide IUPAC Name: 4-[3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoylamino]-N-methylbenzamide Traditional Name: 4-[3-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propanoylamino]-N-methyl-benzamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)CCNC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)CCNC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C18H18N4O4S/c1-19-18(24)12-6-8-13(9-7-12)21-16(23)10-11-20-17-14-4-2-3-5-15(14)27(25,26)22-17/h2-9H,10-11H2,1H3,(H,19,24)(H,20,22)(H,21,23)