N-[5-(1H-benzimidazol-2-ylmethyl)-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[5-(1H-benzimidazol-2-ylmethyl)-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[5-(1H-benzimidazol-2-ylmethyl)-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[5-(1H-benzimidazol-2-ylmethyl)-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[5-(1H-benzimidazol-2-ylmethyl)-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[5-(1H-benzimidazol-2-ylmethyl)-1,3,4-thiadiazol-2-yl]-piperonylamide Formula: C18H13N5O3S MolecularWeight: 379.39252

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NN=C(S3)CC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NN=C(S3)CC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C18H13N5O3S/c24-17(10-5-6-13-14(7-10)26-9-25-13)21-18-23-22-16(27-18)8-15-19-11-3-1-2-4-12(11)20-15/h1-7H,8-9H2,(H,19,20)(H,21,23,24)