N-(5-octyl-1,3,4-thiadiazol-2-yl)-2H-benzotriazole-5-carboxamide

Systemtic Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-2H-benzotriazole-5-carboxamide Openeye Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-2H-benzotriazole-5-carboxamide CAS Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-2H-benzotriazole-5-carboxamide IUPAC Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-2H-benzotriazole-5-carboxamide Traditional Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-2H-benzotriazole-5-carboxamide Formula: C17H22N6OS MolecularWeight: 358.46118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NN=C(S1)NC(=O)C2=CC3=NNN=C3C=C2

Isomeric SMILES

CCCCCCCCC1=NN=C(S1)NC(=O)C2=CC3=NNN=C3C=C2

InChI

InChI=1S/C17H22N6OS/c1-2-3-4-5-6-7-8-15-21-22-17(25-15)18-16(24)12-9-10-13-14(11-12)20-23-19-13/h9-11H,2-8H2,1H3,(H,18,22,24)(H,19,20,23)