3-cyclobutyl-5-cyclohexyl-1-[4-(4,5-dihydro-1H-imidazol-2-ylmethyl)phenyl]-8-methyl-1,3,4-benzotriazepin-2-one

Systemtic Name: 3-cyclobutyl-5-cyclohexyl-1-[4-(4,5-dihydro-1H-imidazol-2-ylmethyl)phenyl]-8-methyl-1,3,4-benzotriazepin-2-one Openeye Name: 3-cyclobutyl-5-cyclohexyl-1-[4-(4,5-dihydro-1H-imidazol-2-ylmethyl)phenyl]-8-methyl-1,3,4-benzotriazepin-2-one CAS Name: 3-cyclobutyl-5-cyclohexyl-1-[4-(4,5-dihydro-1H-imidazol-2-ylmethyl)phenyl]-8-methyl-1,3,4-benzotriazepin-2-one IUPAC Name: 3-cyclobutyl-5-cyclohexyl-1-[4-(4,5-dihydro-1H-imidazol-2-ylmethyl)phenyl]-8-methyl-1,3,4-benzotriazepin-2-one Traditional Name: 3-cyclobutyl-5-cyclohexyl-1-[4-(2-imidazolin-2-ylmethyl)phenyl]-8-methyl-1,3,4-benzotriazepin-2-one Formula: C29H35N5O MolecularWeight: 469.6211

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NN(C(=O)N2C3=CC=C(C=C3)CC4=NCCN4)C5CCC5)C6CCCCC6

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NN(C(=O)N2C3=CC=C(C=C3)CC4=NCCN4)C5CCC5)C6CCCCC6

InChI

InChI=1S/C29H35N5O/c1-20-10-15-25-26(18-20)33(23-13-11-21(12-14-23)19-27-30-16-17-31-27)29(35)34(24-8-5-9-24)32-28(25)22-6-3-2-4-7-22/h10-15,18,22,24H,2-9,16-17,19H2,1H3,(H,30,31)