1-[(E)-[2,6-bis(fluoranyl)phenyl]methylideneamino]-3-butyl-1-methyl-thiourea

Systemtic Name: 1-[(E)-[2,6-bis(fluoranyl)phenyl]methylideneamino]-3-butyl-1-methyl-thiourea Openeye Name: 3-butyl-1-[(E)-(2,6-difluorophenyl)methyleneamino]-1-methyl-thiourea CAS Name: 3-butyl-1-[(E)-(2,6-difluorophenyl)methylideneamino]-1-methylthiourea IUPAC Name: 3-butyl-1-[(E)-(2,6-difluorophenyl)methylideneamino]-1-methylthiourea Traditional Name: 3-butyl-1-[(E)-(2,6-difluorobenzylidene)amino]-1-methyl-thiourea Formula: C13H17F2N3S MolecularWeight: 285.355986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(C)N=CC1=C(C=CC=C1F)F

Isomeric SMILES

CCCCNC(=S)N(C)/N=C/C1=C(C=CC=C1F)F

InChI

InChI=1S/C13H17F2N3S/c1-3-4-8-16-13(19)18(2)17-9-10-11(14)6-5-7-12(10)15/h5-7,9H,3-4,8H2,1-2H3,(H,16,19)/b17-9+