7-(5-fluoranyl-2-methyl-phenyl)-6-methyl-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-benzotriazin-3-amine

Systemtic Name: 7-(5-fluoranyl-2-methyl-phenyl)-6-methyl-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-benzotriazin-3-amine Openeye Name: 7-(5-fluoro-2-methyl-phenyl)-6-methyl-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-benzotriazin-3-amine CAS Name: 7-(5-fluoro-2-methylphenyl)-6-methyl-N-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1,2,4-benzotriazin-3-amine IUPAC Name: 7-(5-fluoro-2-methylphenyl)-6-methyl-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-benzotriazin-3-amine Traditional Name: [7-(5-fluoro-2-methyl-phenyl)-6-methyl-1,2,4-benzotriazin-3-yl]-[4-(2-pyrrolidinoethoxy)phenyl]amine Formula: C27H28FN5O MolecularWeight: 457.542523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)C2=CC3=C(C=C2C)N=C(N=N3)NC4=CC=C(C=C4)OCCN5CCCC5

Isomeric SMILES

CC1=C(C=C(C=C1)F)C2=CC3=C(C=C2C)N=C(N=N3)NC4=CC=C(C=C4)OCCN5CCCC5

InChI

InChI=1S/C27H28FN5O/c1-18-5-6-20(28)16-23(18)24-17-26-25(15-19(24)2)30-27(32-31-26)29-21-7-9-22(10-8-21)34-14-13-33-11-3-4-12-33/h5-10,15-17H,3-4,11-14H2,1-2H3,(H,29,30,32)