3-bis[di(propan-2-yl)amino]phosphinothioyl-2H-benzo[f]benzotriazol-3-ium-4,9-dione

Systemtic Name: 3-bis[di(propan-2-yl)amino]phosphinothioyl-2H-benzo[f]benzotriazol-3-ium-4,9-dione Openeye Name: 3-bis(diisopropylamino)phosphinothioyl-2H-benzo[f]benzotriazol-3-ium-4,9-dione CAS Name: 3-bis[di(propan-2-yl)amino]phosphinothioyl-2H-benzo[f]benzotriazol-3-ium-4,9-dione IUPAC Name: 3-bis[di(propan-2-yl)amino]phosphinothioyl-2H-benzo[f]benzotriazol-3-ium-4,9-dione Traditional Name: 3-bis(diisopropylamino)thiophosphoryl-2H-benzo[f]benzotriazol-3-ium-4,9-quinone Formula: C22H33N5O2PS+ MolecularWeight: 462.568481

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)P(=S)([N+]1=C2C(=NN1)C(=O)C3=CC=CC=C3C2=O)N(C(C)C)C(C)C

Isomeric SMILES

CC(C)N(C(C)C)P(=S)([N+]1=C2C(=NN1)C(=O)C3=CC=CC=C3C2=O)N(C(C)C)C(C)C

InChI

InChI=1S/C22H32N5O2PS/c1-13(2)25(14(3)4)30(31,26(15(5)6)16(7)8)27-20-19(23-24-27)21(28)17-11-9-10-12-18(17)22(20)29/h9-16H,1-8H3/p+1