N-(1,3-benzothiazol-2-ylmethyl)-1-(4-bromophenyl)-N,5-dimethyl-pyrazole-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-bromophenyl)-N,5-dimethyl-pyrazole-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-bromophenyl)-N,5-dimethyl-pyrazole-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-bromophenyl)-N,5-dimethyl-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-bromophenyl)-N,5-dimethylpyrazole-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-bromophenyl)-N,5-dimethyl-pyrazole-4-carboxamide Formula: C20H17BrN4OS MolecularWeight: 441.34418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)N(C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)N(C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H17BrN4OS/c1-13-16(11-22-25(13)15-9-7-14(21)8-10-15)20(26)24(2)12-19-23-17-5-3-4-6-18(17)27-19/h3-11H,12H2,1-2H3