4-(butanoylamino)-N-[1-methyl-2-[2-(2-methylimidazol-1-yl)ethyl]benzimidazol-5-yl]benzamide

Systemtic Name: 4-(butanoylamino)-N-[1-methyl-2-[2-(2-methylimidazol-1-yl)ethyl]benzimidazol-5-yl]benzamide Openeye Name: 4-(butanoylamino)-N-[1-methyl-2-[2-(2-methylimidazol-1-yl)ethyl]benzimidazol-5-yl]benzamide CAS Name: N-[1-methyl-2-[2-(2-methyl-1-imidazolyl)ethyl]-5-benzimidazolyl]-4-(1-oxobutylamino)benzamide IUPAC Name: 4-(butanoylamino)-N-[1-methyl-2-[2-(2-methylimidazol-1-yl)ethyl]benzimidazol-5-yl]benzamide Traditional Name: 4-butyramido-N-[1-methyl-2-[2-(2-methylimidazol-1-yl)ethyl]benzimidazol-5-yl]benzamide Formula: C25H28N6O2 MolecularWeight: 444.52882

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N(C(=N3)CCN4C=CN=C4C)C

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N(C(=N3)CCN4C=CN=C4C)C

InChI

InChI=1S/C25H28N6O2/c1-4-5-24(32)27-19-8-6-18(7-9-19)25(33)28-20-10-11-22-21(16-20)29-23(30(22)3)12-14-31-15-13-26-17(31)2/h6-11,13,15-16H,4-5,12,14H2,1-3H3,(H,27,32)(H,28,33)