3-(2,4-dimethylphenyl)-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 3-(2,4-dimethylphenyl)-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 3-(2,4-dimethylphenyl)-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 3-(2,4-dimethylphenyl)-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-oxolanylmethyl)thiourea IUPAC Name: 3-(2,4-dimethylphenyl)-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-(2,4-dimethylphenyl)-1-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]-1-(tetrahydrofurfuryl)thiourea Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O2S/c1-16-7-9-22(18(3)11-16)27-25(31)28(15-21-5-4-10-30-21)14-20-13-19-8-6-17(2)12-23(19)26-24(20)29/h6-9,11-13,21H,4-5,10,14-15H2,1-3H3,(H,26,29)(H,27,31)