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

Systemtic Name: 4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-prop-2-ynyl-benzamide Openeye Name: 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-prop-2-ynyl-benzamide CAS Name: 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-prop-2-ynylbenzamide IUPAC Name: 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-prop-2-ynylbenzamide Traditional Name: 4-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-propargyl-benzamide Formula: C17H13N3O3S MolecularWeight: 339.36842

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)C1=CC=C(C=C1)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

C#CCNC(=O)C1=CC=C(C=C1)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C17H13N3O3S/c1-2-11-18-17(21)12-7-9-13(10-8-12)19-16-14-5-3-4-6-15(14)24(22,23)20-16/h1,3-10H,11H2,(H,18,21)(H,19,20)