1,3-benzodioxol-5-yl-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)methanone

Systemtic Name: 1,3-benzodioxol-5-yl-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)methanone Openeye Name: 1,3-benzodioxol-5-yl-[3-methoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)methanone IUPAC Name: 1,3-benzodioxol-5-yl-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)methanone Traditional Name: 1,3-benzodioxol-5-yl-[3-methoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]methanone Formula: C15H11N3O4S MolecularWeight: 329.33054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C(=N1)C2=CC=CS2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=NN(C(=N1)C2=CC=CS2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C15H11N3O4S/c1-20-15-16-13(12-3-2-6-23-12)18(17-15)14(19)9-4-5-10-11(7-9)22-8-21-10/h2-7H,8H2,1H3