(4E)-4-[[4-[2-[bis(1-methoxyethyl)amino]ethyl]-3-cyclopropyl-5-methyl-1H-pyrrol-2-yl]methylidene]-2-pyrazin-2-yl-1H-pyrazol-2-ium-5-one

Systemtic Name: (4E)-4-[[4-[2-[bis(1-methoxyethyl)amino]ethyl]-3-cyclopropyl-5-methyl-1H-pyrrol-2-yl]methylidene]-2-pyrazin-2-yl-1H-pyrazol-2-ium-5-one Openeye Name: (4E)-4-[[4-[2-[bis(1-methoxyethyl)amino]ethyl]-3-cyclopropyl-5-methyl-1H-pyrrol-2-yl]methylene]-2-pyrazin-2-yl-1H-pyrazol-2-ium-5-one CAS Name: (4E)-4-[[4-[2-[bis(1-methoxyethyl)amino]ethyl]-3-cyclopropyl-5-methyl-1H-pyrrol-2-yl]methylidene]-2-(2-pyrazinyl)-1H-pyrazol-2-ium-5-one IUPAC Name: (4E)-4-[[4-[2-[bis(1-methoxyethyl)amino]ethyl]-3-cyclopropyl-5-methyl-1H-pyrrol-2-yl]methylidene]-2-pyrazin-2-yl-1H-pyrazol-2-ium-5-one Traditional Name: (4E)-4-[[4-[2-[bis(1-methoxyethyl)amino]ethyl]-3-cyclopropyl-5-methyl-1H-pyrrol-2-yl]methylene]-1-pyrazin-2-yl-2-pyrazolin-1-ium-3-one Formula: C24H33N6O3+ MolecularWeight: 453.55722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C=C2C=[N+](NC2=O)C3=NC=CN=C3)C4CC4)CCN(C(C)OC)C(C)OC

Isomeric SMILES

CC1=C(C(=C(N1)/C=C/2\C=[N+](NC2=O)C3=NC=CN=C3)C4CC4)CCN(C(C)OC)C(C)OC

InChI

InChI=1S/C24H32N6O3/c1-15-20(8-11-29(16(2)32-4)17(3)33-5)23(18-6-7-18)21(27-15)12-19-14-30(28-24(19)31)22-13-25-9-10-26-22/h9-10,12-14,16-18H,6-8,11H2,1-5H3,(H,28,31)/p+1