N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-5-chloro-3-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-5-chloro-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C20H14ClN5O3S MolecularWeight: 439.87486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=NN=C(S2)C3=CC4=C(C=C3)OCO4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=NN=C(S2)C3=CC4=C(C=C3)OCO4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C20H14ClN5O3S/c1-11-16(17(21)26(25-11)13-5-3-2-4-6-13)18(27)22-20-24-23-19(30-20)12-7-8-14-15(9-12)29-10-28-14/h2-9H,10H2,1H3,(H,22,24,27)