1-[(E)-[3,5-bis(trifluoromethyl)phenyl]methylideneamino]-3-methyl-thiourea

Systemtic Name: 1-[(E)-[3,5-bis(trifluoromethyl)phenyl]methylideneamino]-3-methyl-thiourea Openeye Name: 1-[(E)-[3,5-bis(trifluoromethyl)phenyl]methyleneamino]-3-methyl-thiourea CAS Name: 1-[(E)-[3,5-bis(trifluoromethyl)phenyl]methylideneamino]-3-methylthiourea IUPAC Name: 1-[(E)-[3,5-bis(trifluoromethyl)phenyl]methylideneamino]-3-methylthiourea Traditional Name: 1-[(E)-[3,5-bis(trifluoromethyl)benzylidene]amino]-3-methyl-thiourea Formula: C11H9F6N3S MolecularWeight: 329.264679

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NN=CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CNC(=S)N/N=C/C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C11H9F6N3S/c1-18-9(21)20-19-5-6-2-7(10(12,13)14)4-8(3-6)11(15,16)17/h2-5H,1H3,(H2,18,20,21)/b19-5+