N-(5-bromanylpyridin-2-yl)methanamide; 4-carbamimidoyl-N-thiophen-3-yl-benzamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)methanamide; 4-carbamimidoyl-N-thiophen-3-yl-benzamide Openeye Name: N-(5-bromo-2-pyridyl)formamide; 4-carbamimidoyl-N-(3-thienyl)benzamide CAS Name: N-(5-bromo-2-pyridinyl)formamide; 4-carbamimidoyl-N-(3-thiophenyl)benzamide IUPAC Name: N-(5-bromopyridin-2-yl)formamide; 4-carbamimidoyl-N-thiophen-3-ylbenzamide Traditional Name: 4-amidino-N-(3-thienyl)benzamide; N-(5-bromo-2-pyridyl)formamide Formula: C18H16BrN5O2S MolecularWeight: 446.32094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=N)N)C(=O)NC2=CSC=C2.C1=CC(=NC=C1Br)NC=O

Isomeric SMILES

C1=CC(=CC=C1C(=N)N)C(=O)NC2=CSC=C2.C1=CC(=NC=C1Br)NC=O

InChI

InChI=1S/C12H11N3OS.C6H5BrN2O/c13-11(14)8-1-3-9(4-2-8)12(16)15-10-5-6-17-7-10;7-5-1-2-6(8-3-5)9-4-10/h1-7H,(H3,13,14)(H,15,16);1-4H,(H,8,9,10)