1-[3,5-bis(trifluoromethyl)phenyl]-3-(3-chloranyl-4-methyl-phenyl)thiourea

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(3-chloranyl-4-methyl-phenyl)thiourea Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(3-chloro-4-methyl-phenyl)thiourea CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(3-chloro-4-methylphenyl)thiourea IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(3-chloro-4-methylphenyl)thiourea Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(3-chloro-4-methyl-phenyl)thiourea Formula: C16H11ClF6N2S MolecularWeight: 412.780359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)Cl

InChI

InChI=1S/C16H11ClF6N2S/c1-8-2-3-11(7-13(8)17)24-14(26)25-12-5-9(15(18,19)20)4-10(6-12)16(21,22)23/h2-7H,1H3,(H2,24,25,26)