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

Systemtic Name: 3-butyl-1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 3-butyl-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 3-butyl-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 3-butyl-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 3-butyl-1-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(CC1CCCO1)CC2=CC3=C(C=CC(=C3)OCC)NC2=O

Isomeric SMILES

CCCCNC(=S)N(C[C@H]1CCCO1)CC2=CC3=C(C=CC(=C3)OCC)NC2=O

InChI

InChI=1S/C22H31N3O3S/c1-3-5-10-23-22(29)25(15-19-7-6-11-28-19)14-17-12-16-13-18(27-4-2)8-9-20(16)24-21(17)26/h8-9,12-13,19H,3-7,10-11,14-15H2,1-2H3,(H,23,29)(H,24,26)/t19-/m1/s1