1-(4-methylphenyl)sulfonyl-3-(5-pyrazin-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)urea

Systemtic Name: 1-(4-methylphenyl)sulfonyl-3-(5-pyrazin-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)urea Openeye Name: 1-(p-tolylsulfonyl)-3-(5-pyrazin-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)urea CAS Name: 1-(4-methylphenyl)sulfonyl-3-[5-(2-pyrazinylthio)-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(4-methylphenyl)sulfonyl-3-(5-pyrazin-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)urea Traditional Name: 1-[5-(pyrazin-2-ylthio)-1,3,4-thiadiazol-2-yl]-3-tosyl-urea Formula: C14H12N6O3S3 MolecularWeight: 408.47848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=NN=C(S2)SC3=NC=CN=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=NN=C(S2)SC3=NC=CN=C3

InChI

InChI=1S/C14H12N6O3S3/c1-9-2-4-10(5-3-9)26(22,23)20-12(21)17-13-18-19-14(25-13)24-11-8-15-6-7-16-11/h2-8H,1H3,(H2,17,18,20,21)