5-methyl-N2-[4-(4-methylpiperazin-1-yl)phenyl]-N4-(3-pyrrol-1-ylphenyl)pyrimidine-2,4-diamine

Systemtic Name: 5-methyl-N2-[4-(4-methylpiperazin-1-yl)phenyl]-N4-(3-pyrrol-1-ylphenyl)pyrimidine-2,4-diamine Openeye Name: 5-methyl-N2-[4-(4-methylpiperazin-1-yl)phenyl]-N4-(3-pyrrol-1-ylphenyl)pyrimidine-2,4-diamine CAS Name: 5-methyl-N2-[4-(4-methyl-1-piperazinyl)phenyl]-N4-[3-(1-pyrrolyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 5-methyl-2-N-[4-(4-methylpiperazin-1-yl)phenyl]-4-N-(3-pyrrol-1-ylphenyl)pyrimidine-2,4-diamine Traditional Name: [5-methyl-2-[4-(4-methylpiperazino)anilino]pyrimidin-4-yl]-(3-pyrrol-1-ylphenyl)amine Formula: C26H29N7 MolecularWeight: 439.55536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1NC2=CC=CC(=C2)N3C=CC=C3)NC4=CC=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CC1=CN=C(N=C1NC2=CC=CC(=C2)N3C=CC=C3)NC4=CC=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C26H29N7/c1-20-19-27-26(29-21-8-10-23(11-9-21)33-16-14-31(2)15-17-33)30-25(20)28-22-6-5-7-24(18-22)32-12-3-4-13-32/h3-13,18-19H,14-17H2,1-2H3,(H2,27,28,29,30)