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

Systemtic Name: N-(4-bromophenyl)-5-methyl-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(4-bromophenyl)-5-methyl-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(4-bromophenyl)-5-methyl-4-(1-pyrrolidinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(4-bromophenyl)-5-methyl-4-pyrrolidin-1-ylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(4-bromophenyl)-5-methyl-4-pyrrolidino-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C18H17BrN4OS MolecularWeight: 417.32278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCCC3)C(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCCC3)C(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C18H17BrN4OS/c1-11-14-16(23-8-2-3-9-23)20-10-21-18(14)25-15(11)17(24)22-13-6-4-12(19)5-7-13/h4-7,10H,2-3,8-9H2,1H3,(H,22,24)