7-(4-cyclohexylpiperazin-4-ium-1-yl)carbonyl-3-(3-ethoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 7-(4-cyclohexylpiperazin-4-ium-1-yl)carbonyl-3-(3-ethoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-(4-cyclohexylpiperazin-4-ium-1-carbonyl)-3-(3-ethoxypropyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[(4-cyclohexyl-1-piperazin-4-iumyl)-oxomethyl]-3-(3-ethoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-(4-cyclohexylpiperazin-4-ium-1-carbonyl)-3-(3-ethoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-(4-cyclohexylpiperazin-4-ium-1-carbonyl)-3-(3-ethoxypropyl)-2-thioxo-1H-quinazolin-4-one Formula: C24H35N4O3S+ MolecularWeight: 459.6247

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CC[NH+](CC3)C4CCCCC4)NC1=S

Isomeric SMILES

CCOCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CC[NH+](CC3)C4CCCCC4)NC1=S

InChI

InChI=1S/C24H34N4O3S/c1-2-31-16-6-11-28-23(30)20-10-9-18(17-21(20)25-24(28)32)22(29)27-14-12-26(13-15-27)19-7-4-3-5-8-19/h9-10,17,19H,2-8,11-16H2,1H3,(H,25,32)/p+1