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

Systemtic Name: 1-(2-hydroxyethyl)-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-methylphenyl)thiourea Openeye Name: 1-(2-hydroxyethyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(p-tolyl)thiourea CAS Name: 1-(2-hydroxyethyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methylphenyl)thiourea IUPAC Name: 1-(2-hydroxyethyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methylphenyl)thiourea Traditional Name: 1-(2-hydroxyethyl)-1-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-3-(p-tolyl)thiourea Formula: C21H23N3O2S MolecularWeight: 381.49122

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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)C)NC2=O

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O2S/c1-14-3-6-18(7-4-14)22-21(27)24(9-10-25)13-17-12-16-11-15(2)5-8-19(16)23-20(17)26/h3-8,11-12,25H,9-10,13H2,1-2H3,(H,22,27)(H,23,26)