3-[[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]methyl]-1-ethyl-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 3-[[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]methyl]-1-ethyl-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 3-[(1-benzyl-5-chloro-benzimidazol-2-yl)methyl]-1-ethyl-2,4-dioxo-pyrimidine-5-carbonitrile CAS Name: 3-[[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]methyl]-1-ethyl-2,4-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 3-[(1-benzyl-5-chlorobenzimidazol-2-yl)methyl]-1-ethyl-2,4-dioxopyrimidine-5-carbonitrile Traditional Name: 3-[(1-benzyl-5-chloro-benzimidazol-2-yl)methyl]-1-ethyl-2,4-diketo-pyrimidine-5-carbonitrile Formula: C22H18ClN5O2 MolecularWeight: 419.86362

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)N(C1=O)CC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl)C#N

Isomeric SMILES

CCN1C=C(C(=O)N(C1=O)CC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl)C#N

InChI

InChI=1S/C22H18ClN5O2/c1-2-26-13-16(11-24)21(29)28(22(26)30)14-20-25-18-10-17(23)8-9-19(18)27(20)12-15-6-4-3-5-7-15/h3-10,13H,2,12,14H2,1H3