3-butyl-1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 3-butyl-1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 3-butyl-1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 3-butyl-1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 3-butyl-1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 3-butyl-1-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C23H35N4O2S+ MolecularWeight: 431.6146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(CC[NH+]1CCOCC1)CC2=CC3=C(C=CC(=C3NC2=O)C)C

Isomeric SMILES

CCCCNC(=S)N(CC[NH+]1CCOCC1)CC2=CC3=C(C=CC(=C3NC2=O)C)C

InChI

InChI=1S/C23H34N4O2S/c1-4-5-8-24-23(30)27(10-9-26-11-13-29-14-12-26)16-19-15-20-17(2)6-7-18(3)21(20)25-22(19)28/h6-7,15H,4-5,8-14,16H2,1-3H3,(H,24,30)(H,25,28)/p+1