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

Systemtic Name: N2-(3-chloranyl-4-methoxy-phenyl)-N4-phenyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine hydrochloride Openeye Name: N2-(3-chloro-4-methoxy-phenyl)-N4-phenyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine hydrochloride CAS Name: N2-(3-chloro-4-methoxyphenyl)-N4-phenyl-6-(1-pyrrolidinyl)-1,3,5-triazine-2,4-diamine hydrochloride IUPAC Name: 2-N-(3-chloro-4-methoxyphenyl)-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)-(3-chloro-4-methoxy-phenyl)amine hydrochloride Formula: C20H22Cl2N6O MolecularWeight: 433.33428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCCC4)Cl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCCC4)Cl.Cl

InChI

InChI=1S/C20H21ClN6O.ClH/c1-28-17-10-9-15(13-16(17)21)23-19-24-18(22-14-7-3-2-4-8-14)25-20(26-19)27-11-5-6-12-27;/h2-4,7-10,13H,5-6,11-12H2,1H3,(H2,22,23,24,25,26);1H