3-(3-pyrrolidin-1-ium-1-ylpropyl)-2-sulfanylidene-1H-benzo[g]quinazolin-4-one

Systemtic Name: 3-(3-pyrrolidin-1-ium-1-ylpropyl)-2-sulfanylidene-1H-benzo[g]quinazolin-4-one Openeye Name: 3-(3-pyrrolidin-1-ium-1-ylpropyl)-2-thioxo-1H-benzo[g]quinazolin-4-one CAS Name: 3-[3-(1-pyrrolidin-1-iumyl)propyl]-2-sulfanylidene-1H-benzo[g]quinazolin-4-one IUPAC Name: 3-(3-pyrrolidin-1-ium-1-ylpropyl)-2-sulfanylidene-1H-benzo[g]quinazolin-4-one Traditional Name: 3-(3-pyrrolidin-1-ium-1-ylpropyl)-2-thioxo-1H-benzo[g]quinazolin-4-one Formula: C19H22N3OS+ MolecularWeight: 340.46248

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCN2C(=O)C3=CC4=CC=CC=C4C=C3NC2=S

Isomeric SMILES

C1CC[NH+](C1)CCCN2C(=O)C3=CC4=CC=CC=C4C=C3NC2=S

InChI

InChI=1S/C19H21N3OS/c23-18-16-12-14-6-1-2-7-15(14)13-17(16)20-19(24)22(18)11-5-10-21-8-3-4-9-21/h1-2,6-7,12-13H,3-5,8-11H2,(H,20,24)/p+1