3-(2,5-dimethylphenyl)-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ylethyl)thiourea

Systemtic Name: 3-(2,5-dimethylphenyl)-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ylethyl)thiourea Openeye Name: 3-(2,5-dimethylphenyl)-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-morpholinoethyl)thiourea CAS Name: 3-(2,5-dimethylphenyl)-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[2-(4-morpholinyl)ethyl]thiourea IUPAC Name: 3-(2,5-dimethylphenyl)-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ylethyl)thiourea Traditional Name: 3-(2,5-dimethylphenyl)-1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-1-(2-morpholinoethyl)thiourea Formula: C27H34N4O2S MolecularWeight: 478.64946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCN3CCOCC3)C(=S)NC4=C(C=CC(=C4)C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCN3CCOCC3)C(=S)NC4=C(C=CC(=C4)C)C

InChI

InChI=1S/C27H34N4O2S/c1-4-21-7-8-24-22(16-21)17-23(26(32)28-24)18-31(10-9-30-11-13-33-14-12-30)27(34)29-25-15-19(2)5-6-20(25)3/h5-8,15-17H,4,9-14,18H2,1-3H3,(H,28,32)(H,29,34)