N-[[1-[4-[(2E)-2-aminocarbonyliminopyridin-1-yl]phenyl]imidazol-4-yl]methyl]-5-chloranyl-thiophene-2-carboxamide

Systemtic Name: N-[[1-[4-[(2E)-2-aminocarbonyliminopyridin-1-yl]phenyl]imidazol-4-yl]methyl]-5-chloranyl-thiophene-2-carboxamide Openeye Name: N-[[1-[4-[(2E)-2-carbamoylimino-1-pyridyl]phenyl]imidazol-4-yl]methyl]-5-chloro-thiophene-2-carboxamide CAS Name: N-[[1-[4-[(2E)-2-carbamoylimino-1-pyridinyl]phenyl]-4-imidazolyl]methyl]-5-chloro-2-thiophenecarboxamide IUPAC Name: N-[[1-[4-[(2E)-2-carbamoyliminopyridin-1-yl]phenyl]imidazol-4-yl]methyl]-5-chlorothiophene-2-carboxamide Traditional Name: N-[[1-[4-[(2E)-2-carbamoylimino-1-pyridyl]phenyl]imidazol-4-yl]methyl]-5-chloro-thiophene-2-carboxamide Formula: C21H17ClN6O2S MolecularWeight: 452.91668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=O)N)N(C=C1)C2=CC=C(C=C2)N3C=C(N=C3)CNC(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1=C/C(=N\C(=O)N)/N(C=C1)C2=CC=C(C=C2)N3C=C(N=C3)CNC(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C21H17ClN6O2S/c22-18-9-8-17(31-18)20(29)24-11-14-12-27(13-25-14)15-4-6-16(7-5-15)28-10-2-1-3-19(28)26-21(23)30/h1-10,12-13H,11H2,(H2,23,30)(H,24,29)/b26-19+