5-[(4-methoxyphenyl)methyl]-2-(3-piperazin-1-ylpropylsulfanyl)pyrimidine-4,6-diamine

Systemtic Name: 5-[(4-methoxyphenyl)methyl]-2-(3-piperazin-1-ylpropylsulfanyl)pyrimidine-4,6-diamine Openeye Name: 5-[(4-methoxyphenyl)methyl]-2-(3-piperazin-1-ylpropylsulfanyl)pyrimidine-4,6-diamine CAS Name: 5-[(4-methoxyphenyl)methyl]-2-[3-(1-piperazinyl)propylthio]pyrimidine-4,6-diamine IUPAC Name: 5-[(4-methoxyphenyl)methyl]-2-(3-piperazin-1-ylpropylsulfanyl)pyrimidine-4,6-diamine Traditional Name: [6-amino-5-p-anisyl-2-(3-piperazinopropylthio)pyrimidin-4-yl]amine Formula: C19H28N6OS MolecularWeight: 388.53022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=C(N=C(N=C2N)SCCCN3CCNCC3)N

Isomeric SMILES

COC1=CC=C(C=C1)CC2=C(N=C(N=C2N)SCCCN3CCNCC3)N

InChI

InChI=1S/C19H28N6OS/c1-26-15-5-3-14(4-6-15)13-16-17(20)23-19(24-18(16)21)27-12-2-9-25-10-7-22-8-11-25/h3-6,22H,2,7-13H2,1H3,(H4,20,21,23,24)