N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanamide

Systemtic Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanamide Openeye Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-(3-methyl-2-oxo-benzimidazol-1-yl)propanamide CAS Name: N-[2-[(4-bromophenyl)methyl]-3-pyrazolyl]-3-(3-methyl-2-oxo-1-benzimidazolyl)propanamide IUPAC Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-(3-methyl-2-oxobenzimidazol-1-yl)propanamide Traditional Name: N-[2-(4-bromobenzyl)pyrazol-3-yl]-3-(2-keto-3-methyl-benzimidazol-1-yl)propionamide Formula: C21H20BrN5O2 MolecularWeight: 454.3198

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCC(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCC(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H20BrN5O2/c1-25-17-4-2-3-5-18(17)26(21(25)29)13-11-20(28)24-19-10-12-23-27(19)14-15-6-8-16(22)9-7-15/h2-10,12H,11,13-14H2,1H3,(H,24,28)