N-[5-[(E)-(5-bromanylthiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]-4-butoxy-benzamide

Systemtic Name: N-[5-[(E)-(5-bromanylthiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]-4-butoxy-benzamide Openeye Name: N-[5-[(E)-(5-bromo-2-thienyl)methyleneamino]-1,3,4-thiadiazol-2-yl]-4-butoxy-benzamide CAS Name: N-[5-[(E)-(5-bromo-2-thiophenyl)methylideneamino]-1,3,4-thiadiazol-2-yl]-4-butoxybenzamide IUPAC Name: N-[5-[(E)-(5-bromothiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]-4-butoxybenzamide Traditional Name: N-[5-[(E)-(5-bromo-2-thienyl)methyleneamino]-1,3,4-thiadiazol-2-yl]-4-butoxy-benzamide Formula: C18H17BrN4O2S2 MolecularWeight: 465.38718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)N=CC3=CC=C(S3)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)/N=C/C3=CC=C(S3)Br

InChI

InChI=1S/C18H17BrN4O2S2/c1-2-3-10-25-13-6-4-12(5-7-13)16(24)21-18-23-22-17(27-18)20-11-14-8-9-15(19)26-14/h4-9,11H,2-3,10H2,1H3,(H,21,23,24)/b20-11+