3-(3-chlorophenyl)-1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)thiourea

Systemtic Name: 3-(3-chlorophenyl)-1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)thiourea Openeye Name: 3-(3-chlorophenyl)-1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)thiourea CAS Name: 3-(3-chlorophenyl)-1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)thiourea IUPAC Name: 3-(3-chlorophenyl)-1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)thiourea Traditional Name: 3-(3-chlorophenyl)-1-(2-hydroxyethyl)-1-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]thiourea Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CCO)C(=S)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CCO)C(=S)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H22ClN3O2S/c1-13-6-7-14(2)19-18(13)10-15(20(27)24-19)12-25(8-9-26)21(28)23-17-5-3-4-16(22)11-17/h3-7,10-11,26H,8-9,12H2,1-2H3,(H,23,28)(H,24,27)