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

Systemtic Name: 1-(4-bromophenyl)-3-methyl-N-phenethyl-thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 1-(4-bromophenyl)-3-methyl-N-phenethyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: 1-(4-bromophenyl)-3-methyl-N-phenethyl-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: 1-(4-bromophenyl)-3-methyl-N-phenethylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: 1-(4-bromophenyl)-3-methyl-N-phenethyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C21H18BrN3OS MolecularWeight: 440.35612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NCCC3=CC=CC=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NCCC3=CC=CC=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H18BrN3OS/c1-14-18-13-19(20(26)23-12-11-15-5-3-2-4-6-15)27-21(18)25(24-14)17-9-7-16(22)8-10-17/h2-10,13H,11-12H2,1H3,(H,23,26)