5-(2-azanylpyrimidin-4-yl)-N-[(3-bromophenyl)methyl]thiophene-2-carboxamide

Systemtic Name: 5-(2-azanylpyrimidin-4-yl)-N-[(3-bromophenyl)methyl]thiophene-2-carboxamide Openeye Name: 5-(2-aminopyrimidin-4-yl)-N-[(3-bromophenyl)methyl]thiophene-2-carboxamide CAS Name: 5-(2-amino-4-pyrimidinyl)-N-[(3-bromophenyl)methyl]-2-thiophenecarboxamide IUPAC Name: 5-(2-aminopyrimidin-4-yl)-N-[(3-bromophenyl)methyl]thiophene-2-carboxamide Traditional Name: 5-(2-aminopyrimidin-4-yl)-N-(3-bromobenzyl)thiophene-2-carboxamide Formula: C16H13BrN4OS MolecularWeight: 389.26962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CNC(=O)C2=CC=C(S2)C3=NC(=NC=C3)N

Isomeric SMILES

C1=CC(=CC(=C1)Br)CNC(=O)C2=CC=C(S2)C3=NC(=NC=C3)N

InChI

InChI=1S/C16H13BrN4OS/c17-11-3-1-2-10(8-11)9-20-15(22)14-5-4-13(23-14)12-6-7-19-16(18)21-12/h1-8H,9H2,(H,20,22)(H2,18,19,21)