4-[[4-methyl-3-(4-methylphenyl)sulfonyl-1,2,4-thiadiazol-5-ylidene]amino]butanenitrile

Systemtic Name: 4-[[4-methyl-3-(4-methylphenyl)sulfonyl-1,2,4-thiadiazol-5-ylidene]amino]butanenitrile Openeye Name: 4-[[4-methyl-3-(p-tolylsulfonyl)-1,2,4-thiadiazol-5-ylidene]amino]butanenitrile CAS Name: 4-[[4-methyl-3-(4-methylphenyl)sulfonyl-1,2,4-thiadiazol-5-ylidene]amino]butanenitrile IUPAC Name: 4-[[4-methyl-3-(4-methylphenyl)sulfonyl-1,2,4-thiadiazol-5-ylidene]amino]butanenitrile Traditional Name: 4-[(4-methyl-3-tosyl-1,2,4-thiadiazol-5-ylidene)amino]butyronitrile Formula: C14H16N4O2S2 MolecularWeight: 336.43244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=NSC(=NCCCC#N)N2C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=NSC(=NCCCC#N)N2C

InChI

InChI=1S/C14H16N4O2S2/c1-11-5-7-12(8-6-11)22(19,20)14-17-21-13(18(14)2)16-10-4-3-9-15/h5-8H,3-4,10H2,1-2H3