1-(2-ethyl-6-methyl-phenyl)-3-[2-(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)ethyl]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[2-(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)ethyl]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[2-(2-keto-7-methoxy-1H-quinolin-3-yl)ethyl]thiourea Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NCCC2=CC3=C(C=C(C=C3)OC)NC2=O)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NCCC2=CC3=C(C=C(C=C3)OC)NC2=O)C

InChI

InChI=1S/C22H25N3O2S/c1-4-15-7-5-6-14(2)20(15)25-22(28)23-11-10-17-12-16-8-9-18(27-3)13-19(16)24-21(17)26/h5-9,12-13H,4,10-11H2,1-3H3,(H,24,26)(H2,23,25,28)