3-azanyl-N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-4-methyl-benzamide

Systemtic Name: 3-azanyl-N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-4-methyl-benzamide Openeye Name: 3-amino-N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-4-methyl-benzamide CAS Name: 3-amino-N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-4-methylbenzamide IUPAC Name: 3-amino-N-[1-[(4-bromophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-4-methylbenzamide Traditional Name: 3-amino-N-[1-(4-bromobenzyl)-3,5-dimethyl-pyrazol-4-yl]-4-methyl-benzamide Formula: C20H21BrN4O MolecularWeight: 413.31094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(N(N=C2C)CC3=CC=C(C=C3)Br)C)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(N(N=C2C)CC3=CC=C(C=C3)Br)C)N

InChI

InChI=1S/C20H21BrN4O/c1-12-4-7-16(10-18(12)22)20(26)23-19-13(2)24-25(14(19)3)11-15-5-8-17(21)9-6-15/h4-10H,11,22H2,1-3H3,(H,23,26)