N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1,1-dioxo-1,2-benzothiazol-3-amine CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1,1-dioxo-1,2-benzothiazol-3-amine IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1,1-dioxo-1,2-benzothiazol-3-amine Traditional Name: (1,1-diketo-1,2-benzothiazol-3-yl)-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amine Formula: C21H15N3O2S2 MolecularWeight: 405.4927

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC4=NS(=O)(=O)C5=CC=CC=C54

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC4=NS(=O)(=O)C5=CC=CC=C54

InChI

InChI=1S/C21H15N3O2S2/c1-13-6-11-17-18(12-13)27-21(23-17)14-7-9-15(10-8-14)22-20-16-4-2-3-5-19(16)28(25,26)24-20/h2-12H,1H3,(H,22,24)