5-(4-ethylphenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(4-ethylphenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-ethylphenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-ethylphenyl)-N-[4-(4-methyl-1-piperazinyl)phenyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(4-ethylphenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]thieno[2,3-d]pyrimidin-4-amine Traditional Name: [5-(4-ethylphenyl)thieno[2,3-d]pyrimidin-4-yl]-[4-(4-methylpiperazino)phenyl]amine Formula: C25H27N5S MolecularWeight: 429.58038

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=CC=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=CC=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C25H27N5S/c1-3-18-4-6-19(7-5-18)22-16-31-25-23(22)24(26-17-27-25)28-20-8-10-21(11-9-20)30-14-12-29(2)13-15-30/h4-11,16-17H,3,12-15H2,1-2H3,(H,26,27,28)