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

Systemtic Name: 4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-propyl-benzamide Openeye Name: 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-propyl-benzamide CAS Name: 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-propylbenzamide IUPAC Name: 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-propylbenzamide Traditional Name: 4-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-propyl-benzamide Formula: C17H17N3O3S MolecularWeight: 343.40018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=C(C=C1)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CCCNC(=O)C1=CC=C(C=C1)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C17H17N3O3S/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/h3-10H,2,11H2,1H3,(H,18,21)(H,19,20)