3-(2,4-dimethylphenyl)-1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 3-(2,4-dimethylphenyl)-1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 3-(2,4-dimethylphenyl)-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 3-(2,4-dimethylphenyl)-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-oxolanylmethyl)thiourea IUPAC Name: 3-(2,4-dimethylphenyl)-1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-(2,4-dimethylphenyl)-1-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]-1-(tetrahydrofurfuryl)thiourea Formula: C26H31N3O3S MolecularWeight: 465.60764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3CCCO3)C(=S)NC4=C(C=C(C=C4)C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3CCCO3)C(=S)NC4=C(C=C(C=C4)C)C

InChI

InChI=1S/C26H31N3O3S/c1-4-31-21-8-10-24-19(14-21)13-20(25(30)27-24)15-29(16-22-6-5-11-32-22)26(33)28-23-9-7-17(2)12-18(23)3/h7-10,12-14,22H,4-6,11,15-16H2,1-3H3,(H,27,30)(H,28,33)