3-(3-chlorophenyl)-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 3-(3-chlorophenyl)-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 3-(3-chlorophenyl)-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 3-(3-chlorophenyl)-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 3-(3-chlorophenyl)-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 3-(3-chlorophenyl)-1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C26H32ClN4O2S+ MolecularWeight: 500.07588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCC[NH+]3CCOCC3)C(=S)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCC[NH+]3CCOCC3)C(=S)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H31ClN4O2S/c1-2-19-7-8-24-20(15-19)16-21(25(32)29-24)18-31(10-4-9-30-11-13-33-14-12-30)26(34)28-23-6-3-5-22(27)17-23/h3,5-8,15-17H,2,4,9-14,18H2,1H3,(H,28,34)(H,29,32)/p+1