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

Systemtic Name: 7-(2,6-dimethylphenyl)-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-benzotriazin-3-amine Openeye Name: 7-(2,6-dimethylphenyl)-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-benzotriazin-3-amine CAS Name: 7-(2,6-dimethylphenyl)-N-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1,2,4-benzotriazin-3-amine IUPAC Name: 7-(2,6-dimethylphenyl)-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-benzotriazin-3-amine Traditional Name: [7-(2,6-dimethylphenyl)-1,2,4-benzotriazin-3-yl]-[4-(2-pyrrolidinoethoxy)phenyl]amine Formula: C27H29N5O MolecularWeight: 439.55206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N5O/c1-19-6-5-7-20(2)26(19)21-8-13-24-25(18-21)30-31-27(29-24)28-22-9-11-23(12-10-22)33-17-16-32-14-3-4-15-32/h5-13,18H,3-4,14-17H2,1-2H3,(H,28,29,31)