1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-phenyl-thiourea

Systemtic Name: 1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-phenyl-thiourea Openeye Name: 1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-phenyl-thiourea CAS Name: 1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-phenylthiourea IUPAC Name: 1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-phenylthiourea Traditional Name: 1-(2-hydroxyethyl)-1-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]-3-phenyl-thiourea Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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