[(2E)-2-[(2-aminophenyl)-azanyl-methylidene]benzimidazol-5-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [(2E)-2-[(2-aminophenyl)-azanyl-methylidene]benzimidazol-5-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [(2E)-2-[amino-(2-aminophenyl)methylene]benzimidazol-5-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: [(2E)-2-[amino-(2-aminophenyl)methylidene]-5-benzimidazolyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [(2E)-2-[amino-(2-aminophenyl)methylidene]benzimidazol-5-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [(2E)-2-[amino-(2-aminophenyl)methylene]benzimidazol-5-yl]-(4-methylpiperazino)methanone Formula: C20H22N6O MolecularWeight: 362.42828

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC3=NC(=C(C4=CC=CC=C4N)N)N=C3C=C2

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC3=N/C(=C(\C4=CC=CC=C4N)/N)/N=C3C=C2

InChI

InChI=1S/C20H22N6O/c1-25-8-10-26(11-9-25)20(27)13-6-7-16-17(12-13)24-19(23-16)18(22)14-4-2-3-5-15(14)21/h2-7,12H,8-11,21-22H2,1H3/b19-18+