1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-(4-methoxyphenyl)thiourea CAS Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-(4-methoxyphenyl)thiourea Traditional Name: 1-(2-hydroxyethyl)-1-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CCO)C(=S)NC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CCO)C(=S)NC3=CC=C(C=C3)OC)C

InChI

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