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

Systemtic Name: 3-(2,4-dimethylphenyl)-1-(2-hydroxyethyl)-1-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 3-(2,4-dimethylphenyl)-1-(2-hydroxyethyl)-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-(2,4-dimethylphenyl)-1-(2-hydroxyethyl)-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 3-(2,4-dimethylphenyl)-1-(2-hydroxyethyl)-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-(2,4-dimethylphenyl)-1-(2-hydroxyethyl)-1-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]thiourea Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N(CCO)CC2=CC3=C(C=CC(=C3)OC)NC2=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N(CCO)CC2=CC3=C(C=CC(=C3)OC)NC2=O)C

InChI

InChI=1S/C22H25N3O3S/c1-14-4-6-19(15(2)10-14)24-22(29)25(8-9-26)13-17-11-16-12-18(28-3)5-7-20(16)23-21(17)27/h4-7,10-12,26H,8-9,13H2,1-3H3,(H,23,27)(H,24,29)