cyclopentyl-cyclopropyl-[(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)methyl]azanium

Systemtic Name: cyclopentyl-cyclopropyl-[(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)methyl]azanium Openeye Name: cyclopentyl-cyclopropyl-[[1-oxo-4-(2-thienyl)phthalazin-2-yl]methyl]ammonium CAS Name: cyclopentyl-cyclopropyl-[(1-oxo-4-thiophen-2-yl-2-phthalazinyl)methyl]ammonium IUPAC Name: cyclopentyl-cyclopropyl-[(1-oxo-4-thiophen-2-ylphthalazin-2-yl)methyl]azanium Traditional Name: cyclopentyl-cyclopropyl-[[1-keto-4-(2-thienyl)phthalazin-2-yl]methyl]ammonium Formula: C21H24N3OS+ MolecularWeight: 366.49976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+](CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4)C5CC5

Isomeric SMILES

C1CCC(C1)[NH+](CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4)C5CC5

InChI

InChI=1S/C21H23N3OS/c25-21-18-9-4-3-8-17(18)20(19-10-5-13-26-19)22-24(21)14-23(16-11-12-16)15-6-1-2-7-15/h3-5,8-10,13,15-16H,1-2,6-7,11-12,14H2/p+1