2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(pyridin-4-ylmethyl)hexanamide

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(pyridin-4-ylmethyl)hexanamide Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(4-pyridylmethyl)hexanamide CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(pyridin-4-ylmethyl)hexanamide IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(pyridin-4-ylmethyl)hexanamide Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-(4-pyridylmethyl)hexanamide Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NCC1=CC=NC=C1)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CCCCC(C(=O)NCC1=CC=NC=C1)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H22N4O3S/c1-2-3-7-16(19(24)21-13-14-9-11-20-12-10-14)22-18-15-6-4-5-8-17(15)27(25,26)23-18/h4-6,8-12,16H,2-3,7,13H2,1H3,(H,21,24)(H,22,23)