3-methoxy-1-methyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide

Systemtic Name: 3-methoxy-1-methyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide Openeye Name: 3-methoxy-1-methyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide CAS Name: 3-methoxy-1-methyl-N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]-4-pyrazolecarboxamide IUPAC Name: 3-methoxy-1-methyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide Traditional Name: 3-methoxy-1-methyl-N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Formula: C16H15N5O3S2 MolecularWeight: 389.452

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)OC)C(=O)NC2=NN=C(S2)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CN1C=C(C(=N1)OC)C(=O)NC2=NN=C(S2)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H15N5O3S2/c1-21-8-11(14(20-21)24-2)13(23)17-15-18-19-16(26-15)25-9-12(22)10-6-4-3-5-7-10/h3-8H,9H2,1-2H3,(H,17,18,23)