3-(2-ethylphenyl)-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 3-(2-ethylphenyl)-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 3-(2-ethylphenyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 3-(2-ethylphenyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 3-(2-ethylphenyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 3-(2-ethylphenyl)-1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C26H33N4O2S+ MolecularWeight: 465.63082

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CC[NH+]2CCOCC2)CC3=CC4=C(C(=CC=C4)C)NC3=O

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CC[NH+]2CCOCC2)CC3=CC4=C(C(=CC=C4)C)NC3=O

InChI

InChI=1S/C26H32N4O2S/c1-3-20-8-4-5-10-23(20)27-26(33)30(12-11-29-13-15-32-16-14-29)18-22-17-21-9-6-7-19(2)24(21)28-25(22)31/h4-10,17H,3,11-16,18H2,1-2H3,(H,27,33)(H,28,31)/p+1