3-methoxy-1-methyl-N-[5-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide

Systemtic Name: 3-methoxy-1-methyl-N-[5-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Openeye Name: N-[5-[2-(allylamino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-methoxy-1-methyl-pyrazole-4-carboxamide CAS Name: 3-methoxy-1-methyl-N-[5-[[2-oxo-2-(prop-2-enylamino)ethyl]thio]-1,3,4-thiadiazol-2-yl]-4-pyrazolecarboxamide IUPAC Name: 3-methoxy-1-methyl-N-[5-[2-oxo-2-(prop-2-enylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Traditional Name: N-[5-[[2-(allylamino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]-3-methoxy-1-methyl-pyrazole-4-carboxamide Formula: C13H16N6O3S2 MolecularWeight: 368.43454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N6O3S2/c1-4-5-14-9(20)7-23-13-17-16-12(24-13)15-10(21)8-6-19(2)18-11(8)22-3/h4,6H,1,5,7H2,2-3H3,(H,14,20)(H,15,16,21)