4-methylidene-3-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-ethyl]-1H-quinazolin-2-one

Systemtic Name: 4-methylidene-3-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-ethyl]-1H-quinazolin-2-one Openeye Name: 4-methylene-3-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-(2-thienyl)ethyl]-1H-quinazolin-2-one CAS Name: 4-methylene-3-[(2R)-2-(4-methyl-1-piperazin-4-iumyl)-2-thiophen-2-ylethyl]-1H-quinazolin-2-one IUPAC Name: 4-methylidene-3-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-thiophen-2-ylethyl]-1H-quinazolin-2-one Traditional Name: 4-methylene-3-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-(2-thienyl)ethyl]-1H-quinazolin-2-one Formula: C20H25N4OS+ MolecularWeight: 369.5037

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(CN2C(=C)C3=CC=CC=C3NC2=O)C4=CC=CS4

Isomeric SMILES

C[NH+]1CCN(CC1)[C@H](CN2C(=C)C3=CC=CC=C3NC2=O)C4=CC=CS4

InChI

InChI=1S/C20H24N4OS/c1-15-16-6-3-4-7-17(16)21-20(25)24(15)14-18(19-8-5-13-26-19)23-11-9-22(2)10-12-23/h3-8,13,18H,1,9-12,14H2,2H3,(H,21,25)/p+1/t18-/m1/s1