1-[(6,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2-ethylphenyl)-1-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-[(6,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2-ethylphenyl)-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-ethylphenyl)-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-ethylphenyl)-1-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-ethylphenyl)-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-(2-ethylphenyl)-1-[(2-keto-6,8-dimethyl-1H-quinolin-3-yl)methyl]-1-(tetrahydrofurfuryl)thiourea Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CC2CCCO2)CC3=CC4=CC(=CC(=C4NC3=O)C)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CC2CCCO2)CC3=CC4=CC(=CC(=C4NC3=O)C)C

InChI

InChI=1S/C26H31N3O2S/c1-4-19-8-5-6-10-23(19)27-26(32)29(16-22-9-7-11-31-22)15-21-14-20-13-17(2)12-18(3)24(20)28-25(21)30/h5-6,8,10,12-14,22H,4,7,9,11,15-16H2,1-3H3,(H,27,32)(H,28,30)