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

Systemtic Name: 1-(4-bromophenyl)-N-(4-butylphenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 1-(4-bromophenyl)-N-(4-butylphenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: 1-(4-bromophenyl)-N-(4-butylphenyl)-3-methyl-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: 1-(4-bromophenyl)-N-(4-butylphenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: 1-(4-bromophenyl)-N-(4-butylphenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C23H22BrN3OS MolecularWeight: 468.40928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CC3=C(S2)N(N=C3C)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC3=C(S2)N(N=C3C)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H22BrN3OS/c1-3-4-5-16-6-10-18(11-7-16)25-22(28)21-14-20-15(2)26-27(23(20)29-21)19-12-8-17(24)9-13-19/h6-14H,3-5H2,1-2H3,(H,25,28)