3-(3-ethoxypropyl)-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 3-(3-ethoxypropyl)-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 3-(3-ethoxypropyl)-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 3-(3-ethoxypropyl)-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 3-(3-ethoxypropyl)-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 3-(3-ethoxypropyl)-1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C23H33N3O3S MolecularWeight: 431.59142

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3CCCO3)C(=S)NCCCOCC

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C[C@H]3CCCO3)C(=S)NCCCOCC

InChI

InChI=1S/C23H33N3O3S/c1-3-17-8-9-21-18(13-17)14-19(22(27)25-21)15-26(16-20-7-5-12-29-20)23(30)24-10-6-11-28-4-2/h8-9,13-14,20H,3-7,10-12,15-16H2,1-2H3,(H,24,30)(H,25,27)/t20-/m1/s1