3-butyl-1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 3-butyl-1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 3-butyl-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 3-butyl-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 3-butyl-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 3-butyl-1-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C24H37N4O2S+ MolecularWeight: 445.64118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(CCC[NH+]1CCOCC1)CC2=CC3=C(C(=C(C=C3)C)C)NC2=O

Isomeric SMILES

CCCCNC(=S)N(CCC[NH+]1CCOCC1)CC2=CC3=C(C(=C(C=C3)C)C)NC2=O

InChI

InChI=1S/C24H36N4O2S/c1-4-5-9-25-24(31)28(11-6-10-27-12-14-30-15-13-27)17-21-16-20-8-7-18(2)19(3)22(20)26-23(21)29/h7-8,16H,4-6,9-15,17H2,1-3H3,(H,25,31)(H,26,29)/p+1