4-[3-cyclohexyl-6-[2-[(2,4-dimethoxyphenyl)methyl]-1,2,3,4-tetrazol-5-yl]-1H-benzimidazol-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[3-cyclohexyl-6-[2-[(2,4-dimethoxyphenyl)methyl]-1,2,3,4-tetrazol-5-yl]-1H-benzimidazol-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[3-cyclohexyl-6-[2-[(2,4-dimethoxyphenyl)methyl]tetrazol-5-yl]-1H-benzimidazol-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[3-cyclohexyl-6-[2-[(2,4-dimethoxyphenyl)methyl]-5-tetrazolyl]-1H-benzimidazol-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[3-cyclohexyl-6-[2-[(2,4-dimethoxyphenyl)methyl]tetrazol-5-yl]-1H-benzimidazol-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[3-cyclohexyl-6-[2-(2,4-dimethoxybenzyl)tetrazol-5-yl]-1H-benzimidazol-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C29H30N6O3 MolecularWeight: 510.5869

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2N=C(N=N2)C3=CC4=C(C=C3)N(C(=C5C=CC(=O)C=C5)N4)C6CCCCC6)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN2N=C(N=N2)C3=CC4=C(C=C3)N(C(=C5C=CC(=O)C=C5)N4)C6CCCCC6)OC

InChI

InChI=1S/C29H30N6O3/c1-37-24-14-10-21(27(17-24)38-2)18-34-32-28(31-33-34)20-11-15-26-25(16-20)30-29(19-8-12-23(36)13-9-19)35(26)22-6-4-3-5-7-22/h8-17,22,30H,3-7,18H2,1-2H3