5-[(3,5-diethoxy-4-thiophen-3-yl-phenyl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(3,5-diethoxy-4-thiophen-3-yl-phenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3,5-diethoxy-4-(3-thienyl)phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3,5-diethoxy-4-(3-thiophenyl)phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(3,5-diethoxy-4-thiophen-3-ylphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3,5-diethoxy-4-(3-thienyl)benzyl]pyrimidin-4-yl]amine Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1C2=CSC=C2)OCC)CC3=CN=C(N=C3N)N

Isomeric SMILES

CCOC1=CC(=CC(=C1C2=CSC=C2)OCC)CC3=CN=C(N=C3N)N

InChI

InChI=1S/C19H22N4O2S/c1-3-24-15-8-12(7-14-10-22-19(21)23-18(14)20)9-16(25-4-2)17(15)13-5-6-26-11-13/h5-6,8-11H,3-4,7H2,1-2H3,(H4,20,21,22,23)