3-[2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]-N,N-diethyl-benzotriazole-5-sulfonamide

Systemtic Name: 3-[2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]-N,N-diethyl-benzotriazole-5-sulfonamide Openeye Name: 3-[2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethoxy]-N,N-diethyl-benzotriazole-5-sulfonamide CAS Name: 3-[2-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-oxoethoxy]-N,N-diethyl-5-benzotriazolesulfonamide IUPAC Name: 3-[2-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-2-oxoethoxy]-N,N-diethylbenzotriazole-5-sulfonamide Traditional Name: 3-[2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethoxy]-N,N-diethyl-benzotriazole-5-sulfonamide Formula: C21H27N5O4S MolecularWeight: 445.53518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=NN2OCC(=O)C3=C(N(C(=C3)C)C4CC4)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=NN2OCC(=O)C3=C(N(C(=C3)C)C4CC4)C

InChI

InChI=1S/C21H27N5O4S/c1-5-24(6-2)31(28,29)17-9-10-19-20(12-17)26(23-22-19)30-13-21(27)18-11-14(3)25(15(18)4)16-7-8-16/h9-12,16H,5-8,13H2,1-4H3