1-(3-morpholin-4-ium-4-ylpropyl)-3-(4-propan-2-ylphenyl)-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-(4-propan-2-ylphenyl)-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 3-(4-isopropylphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)-1-(4-pyridylmethyl)thiourea CAS Name: 1-[3-(4-morpholin-4-iumyl)propyl]-3-(4-propan-2-ylphenyl)-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-(4-propan-2-ylphenyl)-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-p-cumenyl-1-(4-pyridylmethyl)thiourea Formula: C23H33N4OS+ MolecularWeight: 413.59932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)N(CCC[NH+]2CCOCC2)CC3=CC=NC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)N(CCC[NH+]2CCOCC2)CC3=CC=NC=C3

InChI

InChI=1S/C23H32N4OS/c1-19(2)21-4-6-22(7-5-21)25-23(29)27(18-20-8-10-24-11-9-20)13-3-12-26-14-16-28-17-15-26/h4-11,19H,3,12-18H2,1-2H3,(H,25,29)/p+1