5-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-N-(furan-2-ylmethyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-N-(furan-2-ylmethyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-N-(2-furylmethyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylthio]-N-(2-furanylmethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylsulfanyl]-N-(furan-2-ylmethyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylthio]-1,3,4-thiadiazol-2-yl]-(2-furfuryl)amine Formula: C18H16ClN5OS2 MolecularWeight: 417.93554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CSC2=NN=C(S2)NCC3=CC=CO3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1CSC2=NN=C(S2)NCC3=CC=CO3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C18H16ClN5OS2/c1-12-15(16(19)24(23-12)13-6-3-2-4-7-13)11-26-18-22-21-17(27-18)20-10-14-8-5-9-25-14/h2-9H,10-11H2,1H3,(H,20,21)