4-(4-ethylpiperazin-1-yl)-5-methyl-N-[(2-methylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-(4-ethylpiperazin-1-yl)-5-methyl-N-[(2-methylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(4-ethylpiperazin-1-yl)-5-methyl-N-(o-tolylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(4-ethyl-1-piperazinyl)-5-methyl-N-[(2-methylphenyl)methyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(4-ethylpiperazin-1-yl)-5-methyl-N-[(2-methylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(4-ethylpiperazino)-5-methyl-N-(2-methylbenzyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C3C(=C(SC3=NC=N2)C(=O)NCC4=CC=CC=C4C)C

Isomeric SMILES

CCN1CCN(CC1)C2=C3C(=C(SC3=NC=N2)C(=O)NCC4=CC=CC=C4C)C

InChI

InChI=1S/C22H27N5OS/c1-4-26-9-11-27(12-10-26)20-18-16(3)19(29-22(18)25-14-24-20)21(28)23-13-17-8-6-5-7-15(17)2/h5-8,14H,4,9-13H2,1-3H3,(H,23,28)