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

Systemtic Name: 5-cyclopentyl-1-[4-(4,5-dihydro-1H-imidazol-2-ylmethyl)phenyl]-8-methyl-3-propan-2-yl-1,3,4-benzotriazepin-2-one Openeye Name: 5-cyclopentyl-1-[4-(4,5-dihydro-1H-imidazol-2-ylmethyl)phenyl]-3-isopropyl-8-methyl-1,3,4-benzotriazepin-2-one CAS Name: 5-cyclopentyl-1-[4-(4,5-dihydro-1H-imidazol-2-ylmethyl)phenyl]-8-methyl-3-propan-2-yl-1,3,4-benzotriazepin-2-one IUPAC Name: 5-cyclopentyl-1-[4-(4,5-dihydro-1H-imidazol-2-ylmethyl)phenyl]-8-methyl-3-propan-2-yl-1,3,4-benzotriazepin-2-one Traditional Name: 5-cyclopentyl-1-[4-(2-imidazolin-2-ylmethyl)phenyl]-3-isopropyl-8-methyl-1,3,4-benzotriazepin-2-one Formula: C27H33N5O MolecularWeight: 443.58382

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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)C(C)C)C5CCCC5

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NN(C(=O)N2C3=CC=C(C=C3)CC4=NCCN4)C(C)C)C5CCCC5

InChI

InChI=1S/C27H33N5O/c1-18(2)32-27(33)31(22-11-9-20(10-12-22)17-25-28-14-15-29-25)24-16-19(3)8-13-23(24)26(30-32)21-6-4-5-7-21/h8-13,16,18,21H,4-7,14-15,17H2,1-3H3,(H,28,29)