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

Systemtic Name: 1-[2-(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[2-(2-keto-7-methyl-1H-quinolin-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C20H18F3N3OS MolecularWeight: 405.43663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H18F3N3OS/c1-12-5-6-13-10-14(18(27)26-17(13)9-12)7-8-24-19(28)25-16-4-2-3-15(11-16)20(21,22)23/h2-6,9-11H,7-8H2,1H3,(H,26,27)(H2,24,25,28)