1-[(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl]-1-(2-methoxyethyl)-3-(2-methylphenyl)thiourea

Systemtic Name: 1-[(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl]-1-(2-methoxyethyl)-3-(2-methylphenyl)thiourea Openeye Name: 1-[(2-chloro-7,8-dimethyl-3-quinolyl)methyl]-1-(2-methoxyethyl)-3-(o-tolyl)thiourea CAS Name: 1-[(2-chloro-7,8-dimethyl-3-quinolinyl)methyl]-1-(2-methoxyethyl)-3-(2-methylphenyl)thiourea IUPAC Name: 1-[(2-chloro-7,8-dimethylquinolin-3-yl)methyl]-1-(2-methoxyethyl)-3-(2-methylphenyl)thiourea Traditional Name: 1-[(2-chloro-7,8-dimethyl-3-quinolyl)methyl]-1-(2-methoxyethyl)-3-(o-tolyl)thiourea Formula: C23H26ClN3OS MolecularWeight: 427.99004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C=C2C=C1)CN(CCOC)C(=S)NC3=CC=CC=C3C)Cl)C

Isomeric SMILES

CC1=C(C2=NC(=C(C=C2C=C1)CN(CCOC)C(=S)NC3=CC=CC=C3C)Cl)C

InChI

InChI=1S/C23H26ClN3OS/c1-15-9-10-18-13-19(22(24)26-21(18)17(15)3)14-27(11-12-28-4)23(29)25-20-8-6-5-7-16(20)2/h5-10,13H,11-12,14H2,1-4H3,(H,25,29)