N-[4-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide

Systemtic Name: N-[4-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide Openeye Name: N-[4-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]thiazol-2-yl]pyridine-4-carboxamide CAS Name: N-[4-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-3-pyrrolyl]-2-thiazolyl]-4-pyridinecarboxamide IUPAC Name: N-[4-[1-(1,3-benzodioxol-5-yl)-2,5-dimethylpyrrol-3-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide Traditional Name: N-[4-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]thiazol-2-yl]isonicotinamide Formula: C22H18N4O3S MolecularWeight: 418.46832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C4=CSC(=N4)NC(=O)C5=CC=NC=C5

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C4=CSC(=N4)NC(=O)C5=CC=NC=C5

InChI

InChI=1S/C22H18N4O3S/c1-13-9-17(14(2)26(13)16-3-4-19-20(10-16)29-12-28-19)18-11-30-22(24-18)25-21(27)15-5-7-23-8-6-15/h3-11H,12H2,1-2H3,(H,24,25,27)