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

Systemtic Name: 5-chloranyl-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-[5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C21H18ClN5O3S MolecularWeight: 455.91732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=NN=C(S2)C3=CC(=C(C=C3)OC)OC)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=NN=C(S2)C3=CC(=C(C=C3)OC)OC)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H18ClN5O3S/c1-12-17(18(22)27(26-12)14-7-5-4-6-8-14)19(28)23-21-25-24-20(31-21)13-9-10-15(29-2)16(11-13)30-3/h4-11H,1-3H3,(H,23,25,28)