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

Systemtic Name: 1-(furan-2-ylmethyl)-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-(2-furylmethyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-(2-furanylmethyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-(furan-2-ylmethyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-(2-furfuryl)-1-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C24H31N4O3S+ MolecularWeight: 455.59294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CO3)C(=S)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CO3)C(=S)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C24H30N4O3S/c1-18-5-6-22-19(14-18)15-20(23(29)26-22)16-28(17-21-4-2-11-31-21)24(32)25-7-3-8-27-9-12-30-13-10-27/h2,4-6,11,14-15H,3,7-10,12-13,16-17H2,1H3,(H,25,32)(H,26,29)/p+1