2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-phenylphenyl)ethanone

Systemtic Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-phenylphenyl)ethanone Openeye Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-phenylphenyl)ethanone CAS Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(4-phenylphenyl)ethanone IUPAC Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-phenylphenyl)ethanone Traditional Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(4-phenylphenyl)ethanone Formula: C20H21N3OS2 MolecularWeight: 383.53024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(S1)SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCNC1=NN=C(S1)SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3OS2/c1-2-3-13-21-19-22-23-20(26-19)25-14-18(24)17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-12H,2-3,13-14H2,1H3,(H,21,22)