N-[[1-[4-(4-acetamido-2-oxidanylidene-pyrimidin-1-yl)phenyl]imidazol-4-yl]methyl]-5-chloranyl-thiophene-2-carboxamide

Systemtic Name: N-[[1-[4-(4-acetamido-2-oxidanylidene-pyrimidin-1-yl)phenyl]imidazol-4-yl]methyl]-5-chloranyl-thiophene-2-carboxamide Openeye Name: N-[[1-[4-(4-acetamido-2-oxo-pyrimidin-1-yl)phenyl]imidazol-4-yl]methyl]-5-chloro-thiophene-2-carboxamide CAS Name: N-[[1-[4-(4-acetamido-2-oxo-1-pyrimidinyl)phenyl]-4-imidazolyl]methyl]-5-chloro-2-thiophenecarboxamide IUPAC Name: N-[[1-[4-(4-acetamido-2-oxopyrimidin-1-yl)phenyl]imidazol-4-yl]methyl]-5-chlorothiophene-2-carboxamide Traditional Name: N-[[1-[4-(4-acetamido-2-keto-pyrimidin-1-yl)phenyl]imidazol-4-yl]methyl]-5-chloro-thiophene-2-carboxamide Formula: C21H17ClN6O3S MolecularWeight: 468.91608

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=O)N(C=C1)C2=CC=C(C=C2)N3C=C(N=C3)CNC(=O)C4=CC=C(S4)Cl

Isomeric SMILES

CC(=O)NC1=NC(=O)N(C=C1)C2=CC=C(C=C2)N3C=C(N=C3)CNC(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C21H17ClN6O3S/c1-13(29)25-19-8-9-28(21(31)26-19)16-4-2-15(3-5-16)27-11-14(24-12-27)10-23-20(30)17-6-7-18(22)32-17/h2-9,11-12H,10H2,1H3,(H,23,30)(H,25,26,29,31)