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

Systemtic Name: 4-[4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]butanoylamino]-N-methyl-benzamide Openeye Name: 4-[4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]butanoylamino]-N-methyl-benzamide CAS Name: 4-[[4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-1-oxobutyl]amino]-N-methylbenzamide IUPAC Name: 4-[4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]butanoylamino]-N-methylbenzamide Traditional Name: 4-[4-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]butanoylamino]-N-methyl-benzamide Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)CCCNC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)CCCNC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H20N4O4S/c1-20-19(25)13-8-10-14(11-9-13)22-17(24)7-4-12-21-18-15-5-2-3-6-16(15)28(26,27)23-18/h2-3,5-6,8-11H,4,7,12H2,1H3,(H,20,25)(H,21,23)(H,22,24)