N-[1,3-bis(oxidanylidene)-2-[(3-pyridin-2-ylphenyl)methyl]isoindol-4-yl]-5-chloranyl-thiophene-2-carboxamide

Systemtic Name: N-[1,3-bis(oxidanylidene)-2-[(3-pyridin-2-ylphenyl)methyl]isoindol-4-yl]-5-chloranyl-thiophene-2-carboxamide Openeye Name: 5-chloro-N-[1,3-dioxo-2-[[3-(2-pyridyl)phenyl]methyl]isoindolin-4-yl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[1,3-dioxo-2-[[3-(2-pyridinyl)phenyl]methyl]-4-isoindolyl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[1,3-dioxo-2-[(3-pyridin-2-ylphenyl)methyl]isoindol-4-yl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[1,3-diketo-2-[3-(2-pyridyl)benzyl]isoindolin-4-yl]thiophene-2-carboxamide Formula: C25H16ClN3O3S MolecularWeight: 473.93084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC(=CC=C2)CN3C(=O)C4=C(C3=O)C(=CC=C4)NC(=O)C5=CC=C(S5)Cl

Isomeric SMILES

C1=CC=NC(=C1)C2=CC(=CC=C2)CN3C(=O)C4=C(C3=O)C(=CC=C4)NC(=O)C5=CC=C(S5)Cl

InChI

InChI=1S/C25H16ClN3O3S/c26-21-11-10-20(33-21)23(30)28-19-9-4-7-17-22(19)25(32)29(24(17)31)14-15-5-3-6-16(13-15)18-8-1-2-12-27-18/h1-13H,14H2,(H,28,30)