5-[[(E)-4-(4-methylphenyl)but-3-en-2-ylidene]amino]-1,3,4-thiadiazole-2-sulfonamide

Systemtic Name: 5-[[(E)-4-(4-methylphenyl)but-3-en-2-ylidene]amino]-1,3,4-thiadiazole-2-sulfonamide Openeye Name: 5-[[(E)-1-methyl-3-(p-tolyl)prop-2-enylidene]amino]-1,3,4-thiadiazole-2-sulfonamide CAS Name: 5-[[(E)-4-(4-methylphenyl)but-3-en-2-ylidene]amino]-1,3,4-thiadiazole-2-sulfonamide IUPAC Name: 5-[[(E)-4-(4-methylphenyl)but-3-en-2-ylidene]amino]-1,3,4-thiadiazole-2-sulfonamide Traditional Name: 5-[[(E)-1-methyl-3-(p-tolyl)prop-2-enylidene]amino]-1,3,4-thiadiazole-2-sulfonamide Formula: C13H14N4O2S2 MolecularWeight: 322.40586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=NC2=NN=C(S2)S(=O)(=O)N)C

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=NC2=NN=C(S2)S(=O)(=O)N)C

InChI

InChI=1S/C13H14N4O2S2/c1-9-3-6-11(7-4-9)8-5-10(2)15-12-16-17-13(20-12)21(14,18)19/h3-8H,1-2H3,(H2,14,18,19)/b8-5+,15-10?