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

Systemtic Name: 3-(2,4-dimethylphenyl)-1-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 3-(2,4-dimethylphenyl)-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 3-(2,4-dimethylphenyl)-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-oxolanylmethyl)thiourea IUPAC Name: 3-(2,4-dimethylphenyl)-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-(2,4-dimethylphenyl)-1-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]-1-(tetrahydrofurfuryl)thiourea Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N(CC2CCCO2)CC3=CC4=C(C=CC(=C4)OC)NC3=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N(CC2CCCO2)CC3=CC4=C(C=CC(=C4)OC)NC3=O)C

InChI

InChI=1S/C25H29N3O3S/c1-16-6-8-22(17(2)11-16)27-25(32)28(15-21-5-4-10-31-21)14-19-12-18-13-20(30-3)7-9-23(18)26-24(19)29/h6-9,11-13,21H,4-5,10,14-15H2,1-3H3,(H,26,29)(H,27,32)