1-[2-(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-[4-(trifluoromethyloxy)phenyl]thiourea

Systemtic Name: 1-[2-(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-[4-(trifluoromethyloxy)phenyl]thiourea Openeye Name: 1-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-3-[4-(trifluoromethoxy)phenyl]thiourea CAS Name: 1-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-3-[4-(trifluoromethoxy)phenyl]thiourea IUPAC Name: 1-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-3-[4-(trifluoromethoxy)phenyl]thiourea Traditional Name: 1-[2-(2-keto-7-methoxy-1H-quinolin-3-yl)ethyl]-3-[4-(trifluoromethoxy)phenyl]thiourea Formula: C20H18F3N3O3S MolecularWeight: 437.43543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C20H18F3N3O3S/c1-28-16-5-2-12-10-13(18(27)26-17(12)11-16)8-9-24-19(30)25-14-3-6-15(7-4-14)29-20(21,22)23/h2-7,10-11H,8-9H2,1H3,(H,26,27)(H2,24,25,30)