N-[4,5-dimethyl-3-(phenylsulfonyl)-1-propan-2-yl-pyrrol-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4,5-dimethyl-3-(phenylsulfonyl)-1-propan-2-yl-pyrrol-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-(benzenesulfonyl)-1-isopropyl-4,5-dimethyl-pyrrol-2-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-(benzenesulfonyl)-4,5-dimethyl-1-propan-2-yl-2-pyrrolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-(benzenesulfonyl)-4,5-dimethyl-1-propan-2-ylpyrrol-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-(3-besyl-1-isopropyl-4,5-dimethyl-pyrrol-2-yl)-piperonylamide Formula: C23H24N2O5S MolecularWeight: 440.51206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)OCO4)C(C)C)C

Isomeric SMILES

CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)OCO4)C(C)C)C

InChI

InChI=1S/C23H24N2O5S/c1-14(2)25-16(4)15(3)21(31(27,28)18-8-6-5-7-9-18)22(25)24-23(26)17-10-11-19-20(12-17)30-13-29-19/h5-12,14H,13H2,1-4H3,(H,24,26)