1-[2-(cyclohexen-1-yl)ethyl]-3-[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea

Systemtic Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-[2-oxidanylidene-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Openeye Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea CAS Name: 1-[2-(1-cyclohexenyl)ethyl]-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea IUPAC Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-[2-oxo-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Traditional Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-[2-keto-4-(trifluoromethyl)-1H-quinolin-6-yl]thiourea Formula: C19H20F3N3OS MolecularWeight: 395.44181

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=S)NC2=CC3=C(C=C2)NC(=O)C=C3C(F)(F)F

Isomeric SMILES

C1CCC(=CC1)CCNC(=S)NC2=CC3=C(C=C2)NC(=O)C=C3C(F)(F)F

InChI

InChI=1S/C19H20F3N3OS/c20-19(21,22)15-11-17(26)25-16-7-6-13(10-14(15)16)24-18(27)23-9-8-12-4-2-1-3-5-12/h4,6-7,10-11H,1-3,5,8-9H2,(H,25,26)(H2,23,24,27)