2-[2-(benzotriazol-1-yl)ethanoyl-(pyridin-3-ylmethyl)amino]-N-cyclohexyl-2-(3,4-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(pyridin-3-ylmethyl)amino]-N-cyclohexyl-2-(3,4-dimethoxyphenyl)ethanamide Openeye Name: 2-[[2-(benzotriazol-1-yl)acetyl]-(3-pyridylmethyl)amino]-N-cyclohexyl-2-(3,4-dimethoxyphenyl)acetamide CAS Name: 2-[[2-(1-benzotriazolyl)-1-oxoethyl]-(3-pyridinylmethyl)amino]-N-cyclohexyl-2-(3,4-dimethoxyphenyl)acetamide IUPAC Name: 2-[[2-(benzotriazol-1-yl)acetyl]-(pyridin-3-ylmethyl)amino]-N-cyclohexyl-2-(3,4-dimethoxyphenyl)acetamide Traditional Name: 2-[[2-(benzotriazol-1-yl)acetyl]-(3-pyridylmethyl)amino]-N-cyclohexyl-2-(3,4-dimethoxyphenyl)acetamide Formula: C30H34N6O4 MolecularWeight: 542.62876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C(=O)NC2CCCCC2)N(CC3=CN=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C(=O)NC2CCCCC2)N(CC3=CN=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4)OC

InChI

InChI=1S/C30H34N6O4/c1-39-26-15-14-22(17-27(26)40-2)29(30(38)32-23-10-4-3-5-11-23)35(19-21-9-8-16-31-18-21)28(37)20-36-25-13-7-6-12-24(25)33-34-36/h6-9,12-18,23,29H,3-5,10-11,19-20H2,1-2H3,(H,32,38)