7-(4-ethylpiperazin-4-ium-1-yl)carbonyl-3-propyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 7-(4-ethylpiperazin-4-ium-1-yl)carbonyl-3-propyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-(4-ethylpiperazin-4-ium-1-carbonyl)-3-propyl-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]-3-propyl-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-(4-ethylpiperazin-4-ium-1-carbonyl)-3-propyl-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-(4-ethylpiperazin-4-ium-1-carbonyl)-3-propyl-2-thioxo-1H-quinazolin-4-one Formula: C18H25N4O2S+ MolecularWeight: 361.4817

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CC[NH+](CC3)CC)NC1=S

Isomeric SMILES

CCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CC[NH+](CC3)CC)NC1=S

InChI

InChI=1S/C18H24N4O2S/c1-3-7-22-17(24)14-6-5-13(12-15(14)19-18(22)25)16(23)21-10-8-20(4-2)9-11-21/h5-6,12H,3-4,7-11H2,1-2H3,(H,19,25)/p+1