3-[3-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-3-oxidanylidene-propyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[3-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-3-oxidanylidene-propyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[3-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]-3-oxo-propyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[3-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-3-oxopropyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[3-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]-3-oxopropyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[3-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]-3-keto-propyl]-1,2,3-benzotriazin-4-one Formula: C22H27N7O2 MolecularWeight: 421.49548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)CCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)CCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C22H27N7O2/c1-15(2)21-23-16(3)14-19(24-21)27-10-12-28(13-11-27)20(30)8-9-29-22(31)17-6-4-5-7-18(17)25-26-29/h4-7,14-15H,8-13H2,1-3H3