N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-4-ethanoyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-4-ethanoyl-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-1H-pyrrole-2-carboxamide Formula: C17H13N3O4S MolecularWeight: 355.36782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H13N3O4S/c1-9(21)11-4-12(18-6-11)16(22)20-17-19-13(7-25-17)10-2-3-14-15(5-10)24-8-23-14/h2-7,18H,8H2,1H3,(H,19,20,22)