3-(2-ethylphenyl)-1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 3-(2-ethylphenyl)-1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 3-(2-ethylphenyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 3-(2-ethylphenyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 3-(2-ethylphenyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 3-(2-ethylphenyl)-1-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C26H33N4O3S+ MolecularWeight: 481.63022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32N4O3S/c1-3-19-6-4-5-7-23(19)28-26(34)30(11-10-29-12-14-33-15-13-29)18-21-16-20-8-9-22(32-2)17-24(20)27-25(21)31/h4-9,16-17H,3,10-15,18H2,1-2H3,(H,27,31)(H,28,34)/p+1