N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-pyrrolidinosulfonyl-benzamide Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2)/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N3O5S/c1-14(15-7-8-18-19(12-15)28-13-27-18)21-22-20(24)16-5-4-6-17(11-16)29(25,26)23-9-2-3-10-23/h4-8,11-12H,2-3,9-10,13H2,1H3,(H,22,24)/b21-14+