1-[[1-(3-azanylidene-3-azido-propyl)benzimidazol-2-yl]methyl]-3-[(4-hydroxyphenyl)methyl]benzimidazol-2-one

Systemtic Name: 1-[[1-(3-azanylidene-3-azido-propyl)benzimidazol-2-yl]methyl]-3-[(4-hydroxyphenyl)methyl]benzimidazol-2-one Openeye Name: 3-[2-[[3-[(4-hydroxyphenyl)methyl]-2-oxo-benzimidazol-1-yl]methyl]benzimidazol-1-yl]propanimidoyl azide CAS Name: 1-[[1-(3-azido-3-iminopropyl)-2-benzimidazolyl]methyl]-3-[(4-hydroxyphenyl)methyl]-2-benzimidazolone IUPAC Name: 3-[2-[[3-[(4-hydroxyphenyl)methyl]-2-oxobenzimidazol-1-yl]methyl]benzimidazol-1-yl]propanimidoyl azide Traditional Name: 1-[[1-(3-azido-3-imino-propyl)benzimidazol-2-yl]methyl]-3-(4-hydroxybenzyl)benzimidazol-2-one Formula: C25H22N8O2 MolecularWeight: 466.49458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CCC(=N)N=[N+]=[N-])CN3C4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CCC(=N)N=[N+]=[N-])CN3C4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)O

InChI

InChI=1S/C25H22N8O2/c26-23(29-30-27)13-14-31-20-6-2-1-5-19(20)28-24(31)16-33-22-8-4-3-7-21(22)32(25(33)35)15-17-9-11-18(34)12-10-17/h1-12,26,34H,13-16H2