1-(1,3-benzodioxol-5-yl)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone Openeye Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1,3-benzodioxol-5-yl)ethanone CAS Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-1-(1,3-benzodioxol-5-yl)ethanone IUPAC Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1,3-benzodioxol-5-yl)ethanone Traditional Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-1-(1,3-benzodioxol-5-yl)ethanone Formula: C17H13N3O3S2 MolecularWeight: 371.43342

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)CSC3=NN=C(S3)NC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)CSC3=NN=C(S3)NC4=CC=CC=C4

InChI

InChI=1S/C17H13N3O3S2/c21-13(11-6-7-14-15(8-11)23-10-22-14)9-24-17-20-19-16(25-17)18-12-4-2-1-3-5-12/h1-8H,9-10H2,(H,18,19)