1-(3-bromanyl-4-methoxy-phenyl)-2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(3-bromanyl-4-methoxy-phenyl)-2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(3-bromo-4-methoxy-phenyl)-2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(3-bromo-4-methoxyphenyl)-2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 1-(3-bromo-4-methoxyphenyl)-2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(3-bromo-4-methoxy-phenyl)-2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone Formula: C14H16BrN3O2S2 MolecularWeight: 402.32974

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NN=C(S1)SCC(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CCCNC1=NN=C(S1)SCC(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C14H16BrN3O2S2/c1-3-6-16-13-17-18-14(22-13)21-8-11(19)9-4-5-12(20-2)10(15)7-9/h4-5,7H,3,6,8H2,1-2H3,(H,16,17)