N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[5-(1-naphthalenylmethylthio)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C22H17N3O3S2 MolecularWeight: 435.51868

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NC3=NN=C(S3)SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)C(=O)NC3=NN=C(S3)SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C22H17N3O3S2/c26-20(19-12-27-17-10-3-4-11-18(17)28-19)23-21-24-25-22(30-21)29-13-15-8-5-7-14-6-1-2-9-16(14)15/h1-11,19H,12-13H2,(H,23,24,26)