6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-heptan-2-yl-hexanamide

Systemtic Name: 6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-heptan-2-yl-hexanamide Openeye Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(1-methylhexyl)hexanamide CAS Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-heptan-2-ylhexanamide IUPAC Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-heptan-2-ylhexanamide Traditional Name: 6-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-(1-methylhexyl)hexanamide Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CCCCCNC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CCCCCC(C)NC(=O)CCCCCNC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C20H31N3O3S/c1-3-4-6-11-16(2)22-19(24)14-7-5-10-15-21-20-17-12-8-9-13-18(17)27(25,26)23-20/h8-9,12-13,16H,3-7,10-11,14-15H2,1-2H3,(H,21,23)(H,22,24)