2-[5-cyclohexyl-1-(3,3-dimethyl-2-oxidanylidene-butyl)-2-oxidanylidene-1,3,4-benzotriazepin-3-yl]-N-(3-methoxyphenyl)ethanamide

Systemtic Name: 2-[5-cyclohexyl-1-(3,3-dimethyl-2-oxidanylidene-butyl)-2-oxidanylidene-1,3,4-benzotriazepin-3-yl]-N-(3-methoxyphenyl)ethanamide Openeye Name: 2-[5-cyclohexyl-1-(3,3-dimethyl-2-oxo-butyl)-2-oxo-1,3,4-benzotriazepin-3-yl]-N-(3-methoxyphenyl)acetamide CAS Name: 2-[5-cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-1,3,4-benzotriazepin-3-yl]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-[5-cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-1,3,4-benzotriazepin-3-yl]-N-(3-methoxyphenyl)acetamide Traditional Name: 2-[5-cyclohexyl-2-keto-1-(2-keto-3,3-dimethyl-butyl)-1,3,4-benzotriazepin-3-yl]-N-(3-methoxyphenyl)acetamide Formula: C29H36N4O4 MolecularWeight: 504.62054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=CC=CC=C2C(=NN(C1=O)CC(=O)NC3=CC(=CC=C3)OC)C4CCCCC4

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=CC=CC=C2C(=NN(C1=O)CC(=O)NC3=CC(=CC=C3)OC)C4CCCCC4

InChI

InChI=1S/C29H36N4O4/c1-29(2,3)25(34)18-32-24-16-9-8-15-23(24)27(20-11-6-5-7-12-20)31-33(28(32)36)19-26(35)30-21-13-10-14-22(17-21)37-4/h8-10,13-17,20H,5-7,11-12,18-19H2,1-4H3,(H,30,35)