1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C18H18F3N3S MolecularWeight: 365.41583

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)C=C(C=C2)NC(=S)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CN1CCC2=C(C1)C=C(C=C2)NC(=S)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H18F3N3S/c1-24-8-7-12-5-6-16(9-13(12)11-24)23-17(25)22-15-4-2-3-14(10-15)18(19,20)21/h2-6,9-10H,7-8,11H2,1H3,(H2,22,23,25)