1-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[[(E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoyl]amino]thiourea CAS Name: 1-[[(E)-3-(5-bromo-2-fluorophenyl)-1-oxoprop-2-enyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[[(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoyl]amino]thiourea Traditional Name: 1-benzyl-3-[[(E)-3-(5-bromo-2-fluoro-phenyl)acryloyl]amino]thiourea Formula: C17H15BrFN3OS MolecularWeight: 408.287903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NNC(=O)C=CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NNC(=O)/C=C/C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C17H15BrFN3OS/c18-14-7-8-15(19)13(10-14)6-9-16(23)21-22-17(24)20-11-12-4-2-1-3-5-12/h1-10H,11H2,(H,21,23)(H2,20,22,24)/b9-6+