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

Systemtic Name: N-[(2-bromophenyl)methyl]-4-(4-ethylpiperazin-1-yl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-[(2-bromophenyl)methyl]-4-(4-ethylpiperazin-1-yl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-[(2-bromophenyl)methyl]-4-(4-ethyl-1-piperazinyl)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-[(2-bromophenyl)methyl]-4-(4-ethylpiperazin-1-yl)-5-methylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(2-bromobenzyl)-4-(4-ethylpiperazino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H24BrN5OS MolecularWeight: 474.41716

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C3C(=C(SC3=NC=N2)C(=O)NCC4=CC=CC=C4Br)C

Isomeric SMILES

CCN1CCN(CC1)C2=C3C(=C(SC3=NC=N2)C(=O)NCC4=CC=CC=C4Br)C

InChI

InChI=1S/C21H24BrN5OS/c1-3-26-8-10-27(11-9-26)19-17-14(2)18(29-21(17)25-13-24-19)20(28)23-12-15-6-4-5-7-16(15)22/h4-7,13H,3,8-12H2,1-2H3,(H,23,28)