8-chloranyl-5-cyclohexyl-1-[5-(2-dimethylaminoethylamino)pyridin-2-yl]-3-(oxan-4-yl)-1,3,4-benzotriazepin-2-one

Systemtic Name: 8-chloranyl-5-cyclohexyl-1-[5-(2-dimethylaminoethylamino)pyridin-2-yl]-3-(oxan-4-yl)-1,3,4-benzotriazepin-2-one Openeye Name: 8-chloro-5-cyclohexyl-1-[5-(2-dimethylaminoethylamino)-2-pyridyl]-3-tetrahydropyran-4-yl-1,3,4-benzotriazepin-2-one CAS Name: 8-chloro-5-cyclohexyl-1-[5-(2-dimethylaminoethylamino)-2-pyridinyl]-3-(4-oxanyl)-1,3,4-benzotriazepin-2-one IUPAC Name: 8-chloro-5-cyclohexyl-1-[5-(2-dimethylaminoethylamino)pyridin-2-yl]-3-(oxan-4-yl)-1,3,4-benzotriazepin-2-one Traditional Name: 8-chloro-5-cyclohexyl-1-[5-(2-dimethylaminoethylamino)-2-pyridyl]-3-tetrahydropyran-4-yl-1,3,4-benzotriazepin-2-one Formula: C28H37ClN6O2 MolecularWeight: 525.08538

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC1=CN=C(C=C1)N2C3=C(C=CC(=C3)Cl)C(=NN(C2=O)C4CCOCC4)C5CCCCC5

Isomeric SMILES

CN(C)CCNC1=CN=C(C=C1)N2C3=C(C=CC(=C3)Cl)C(=NN(C2=O)C4CCOCC4)C5CCCCC5

InChI

InChI=1S/C28H37ClN6O2/c1-33(2)15-14-30-22-9-11-26(31-19-22)34-25-18-21(29)8-10-24(25)27(20-6-4-3-5-7-20)32-35(28(34)36)23-12-16-37-17-13-23/h8-11,18-20,23,30H,3-7,12-17H2,1-2H3