2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-pentyl-hexanamide

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-pentyl-hexanamide Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-pentyl-hexanamide CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-pentylhexanamide IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-pentylhexanamide Traditional Name: N-amyl-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]hexanamide Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(CCCC)NC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CCCCCNC(=O)C(CCCC)NC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C18H27N3O3S/c1-3-5-9-13-19-18(22)15(11-6-4-2)20-17-14-10-7-8-12-16(14)25(23,24)21-17/h7-8,10,12,15H,3-6,9,11,13H2,1-2H3,(H,19,22)(H,20,21)