N2-(4-ethoxyphenyl)-N4-phenyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine hydrochloride

Systemtic Name: N2-(4-ethoxyphenyl)-N4-phenyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine hydrochloride Openeye Name: N2-(4-ethoxyphenyl)-N4-phenyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine hydrochloride CAS Name: N2-(4-ethoxyphenyl)-N4-phenyl-6-(1-pyrrolidinyl)-1,3,5-triazine-2,4-diamine hydrochloride IUPAC Name: 2-N-(4-ethoxyphenyl)-4-N-phenyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine hydrochloride Traditional Name: (4-anilino-6-pyrrolidino-s-triazin-2-yl)-p-phenetyl-amine hydrochloride Formula: C21H25ClN6O MolecularWeight: 412.9158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCCC4.Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCCC4.Cl

InChI

InChI=1S/C21H24N6O.ClH/c1-2-28-18-12-10-17(11-13-18)23-20-24-19(22-16-8-4-3-5-9-16)25-21(26-20)27-14-6-7-15-27;/h3-5,8-13H,2,6-7,14-15H2,1H3,(H2,22,23,24,25,26);1H