4-(1,2-benzothiazol-3-yl)-N-(2,1,3-benzoxadiazol-4-yl)piperazine-1-carbothioamide

Systemtic Name: 4-(1,2-benzothiazol-3-yl)-N-(2,1,3-benzoxadiazol-4-yl)piperazine-1-carbothioamide Openeye Name: 4-(1,2-benzothiazol-3-yl)-N-(2,1,3-benzoxadiazol-4-yl)piperazine-1-carbothioamide CAS Name: 4-(1,2-benzothiazol-3-yl)-N-(2,1,3-benzoxadiazol-4-yl)-1-piperazinecarbothioamide IUPAC Name: 4-(1,2-benzothiazol-3-yl)-N-(2,1,3-benzoxadiazol-4-yl)piperazine-1-carbothioamide Traditional Name: N-benzofurazan-4-yl-4-(1,2-benzothiazol-3-yl)piperazine-1-carbothioamide Formula: C18H16N6OS2 MolecularWeight: 396.48924

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NSC3=CC=CC=C32)C(=S)NC4=CC=CC5=NON=C54

Isomeric SMILES

C1CN(CCN1C2=NSC3=CC=CC=C32)C(=S)NC4=CC=CC5=NON=C54

InChI

InChI=1S/C18H16N6OS2/c26-18(19-13-5-3-6-14-16(13)21-25-20-14)24-10-8-23(9-11-24)17-12-4-1-2-7-15(12)27-22-17/h1-7H,8-11H2,(H,19,26)