5-cyclohexyl-8-methyl-1-[5-[(1-methylpiperidin-4-yl)methylamino]pyridin-2-yl]-3-propan-2-yl-1,3,4-benzotriazepin-2-one

Systemtic Name: 5-cyclohexyl-8-methyl-1-[5-[(1-methylpiperidin-4-yl)methylamino]pyridin-2-yl]-3-propan-2-yl-1,3,4-benzotriazepin-2-one Openeye Name: 5-cyclohexyl-3-isopropyl-8-methyl-1-[5-[(1-methyl-4-piperidyl)methylamino]-2-pyridyl]-1,3,4-benzotriazepin-2-one CAS Name: 5-cyclohexyl-8-methyl-1-[5-[(1-methyl-4-piperidinyl)methylamino]-2-pyridinyl]-3-propan-2-yl-1,3,4-benzotriazepin-2-one IUPAC Name: 5-cyclohexyl-8-methyl-1-[5-[(1-methylpiperidin-4-yl)methylamino]pyridin-2-yl]-3-propan-2-yl-1,3,4-benzotriazepin-2-one Traditional Name: 5-cyclohexyl-3-isopropyl-8-methyl-1-[5-[(1-methyl-4-piperidyl)methylamino]-2-pyridyl]-1,3,4-benzotriazepin-2-one Formula: C30H42N6O MolecularWeight: 502.69408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NN(C(=O)N2C3=NC=C(C=C3)NCC4CCN(CC4)C)C(C)C)C5CCCCC5

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NN(C(=O)N2C3=NC=C(C=C3)NCC4CCN(CC4)C)C(C)C)C5CCCCC5

InChI

InChI=1S/C30H42N6O/c1-21(2)36-30(37)35(28-13-11-25(20-32-28)31-19-23-14-16-34(4)17-15-23)27-18-22(3)10-12-26(27)29(33-36)24-8-6-5-7-9-24/h10-13,18,20-21,23-24,31H,5-9,14-17,19H2,1-4H3