1-(4-bromophenyl)-N-(2,4-dimethoxyphenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: 1-(4-bromophenyl)-N-(2,4-dimethoxyphenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 1-(4-bromophenyl)-N-(2,4-dimethoxyphenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: 1-(4-bromophenyl)-N-(2,4-dimethoxyphenyl)-3-methyl-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: 1-(4-bromophenyl)-N-(2,4-dimethoxyphenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: 1-(4-bromophenyl)-N-(2,4-dimethoxyphenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C21H18BrN3O3S MolecularWeight: 472.35492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NC3=C(C=C(C=C3)OC)OC)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NC3=C(C=C(C=C3)OC)OC)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H18BrN3O3S/c1-12-16-11-19(20(26)23-17-9-8-15(27-2)10-18(17)28-3)29-21(16)25(24-12)14-6-4-13(22)5-7-14/h4-11H,1-3H3,(H,23,26)