5-methyl-7-pyrimidin-4-yl-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-benzotriazin-3-amine

Systemtic Name: 5-methyl-7-pyrimidin-4-yl-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-benzotriazin-3-amine Openeye Name: 5-methyl-7-pyrimidin-4-yl-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-benzotriazin-3-amine CAS Name: 5-methyl-7-(4-pyrimidinyl)-N-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1,2,4-benzotriazin-3-amine IUPAC Name: 5-methyl-7-pyrimidin-4-yl-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-benzotriazin-3-amine Traditional Name: [5-methyl-7-(4-pyrimidyl)-1,2,4-benzotriazin-3-yl]-[4-(2-pyrrolidinoethoxy)phenyl]amine Formula: C24H25N7O MolecularWeight: 427.5016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C3=NC=NC=C3)N=NC(=N2)NC4=CC=C(C=C4)OCCN5CCCC5

Isomeric SMILES

CC1=C2C(=CC(=C1)C3=NC=NC=C3)N=NC(=N2)NC4=CC=C(C=C4)OCCN5CCCC5

InChI

InChI=1S/C24H25N7O/c1-17-14-18(21-8-9-25-16-26-21)15-22-23(17)28-24(30-29-22)27-19-4-6-20(7-5-19)32-13-12-31-10-2-3-11-31/h4-9,14-16H,2-3,10-13H2,1H3,(H,27,28,30)