3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-butyl-propanamide

Systemtic Name: 3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-butyl-propanamide Openeye Name: N-butyl-3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanamide CAS Name: N-butyl-3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanamide IUPAC Name: N-butyl-3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanamide Traditional Name: N-butyl-3-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propionamide Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CCNC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CCCCNC(=O)CCNC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C14H19N3O3S/c1-2-3-9-15-13(18)8-10-16-14-11-6-4-5-7-12(11)21(19,20)17-14/h4-7H,2-3,8-10H2,1H3,(H,15,18)(H,16,17)