N-(2,1,3-benzoxadiazol-4-yl)-4-(1-methylbenzimidazol-2-yl)piperidine-1-carbothioamide

Systemtic Name: N-(2,1,3-benzoxadiazol-4-yl)-4-(1-methylbenzimidazol-2-yl)piperidine-1-carbothioamide Openeye Name: N-(2,1,3-benzoxadiazol-4-yl)-4-(1-methylbenzimidazol-2-yl)piperidine-1-carbothioamide CAS Name: N-(2,1,3-benzoxadiazol-4-yl)-4-(1-methyl-2-benzimidazolyl)-1-piperidinecarbothioamide IUPAC Name: N-(2,1,3-benzoxadiazol-4-yl)-4-(1-methylbenzimidazol-2-yl)piperidine-1-carbothioamide Traditional Name: N-benzofurazan-4-yl-4-(1-methylbenzimidazol-2-yl)piperidine-1-carbothioamide Formula: C20H20N6OS MolecularWeight: 392.4774

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C3CCN(CC3)C(=S)NC4=CC=CC5=NON=C54

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C3CCN(CC3)C(=S)NC4=CC=CC5=NON=C54

InChI

InChI=1S/C20H20N6OS/c1-25-17-8-3-2-5-14(17)21-19(25)13-9-11-26(12-10-13)20(28)22-15-6-4-7-16-18(15)24-27-23-16/h2-8,13H,9-12H2,1H3,(H,22,28)