2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(1-ethylbenzimidazol-2-yl)-4-methylsulfanyl-butanamide

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(1-ethylbenzimidazol-2-yl)-4-methylsulfanyl-butanamide Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(1-ethylbenzimidazol-2-yl)-4-methylsulfanyl-butanamide CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(1-ethyl-2-benzimidazolyl)-4-(methylthio)butanamide IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(1-ethylbenzimidazol-2-yl)-4-methylsulfanylbutanamide Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-(1-ethylbenzimidazol-2-yl)-4-(methylthio)butyramide Formula: C21H23N5O3S2 MolecularWeight: 457.56902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1NC(=O)C(CCSC)NC3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1NC(=O)C(CCSC)NC3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H23N5O3S2/c1-3-26-17-10-6-5-9-15(17)23-21(26)24-20(27)16(12-13-30-2)22-19-14-8-4-7-11-18(14)31(28,29)25-19/h4-11,16H,3,12-13H2,1-2H3,(H,22,25)(H,23,24,27)