1-[2-(3-fluoranyl-4-methoxy-phenyl)ethanoylamino]-3-[(2S)-2-methylheptyl]thiourea

Systemtic Name: 1-[2-(3-fluoranyl-4-methoxy-phenyl)ethanoylamino]-3-[(2S)-2-methylheptyl]thiourea Openeye Name: 1-[[2-(3-fluoro-4-methoxy-phenyl)acetyl]amino]-3-[(2S)-2-methylheptyl]thiourea CAS Name: 1-[[2-(3-fluoro-4-methoxyphenyl)-1-oxoethyl]amino]-3-[(2S)-2-methylheptyl]thiourea IUPAC Name: 1-[[2-(3-fluoro-4-methoxyphenyl)acetyl]amino]-3-[(2S)-2-methylheptyl]thiourea Traditional Name: 1-[[2-(3-fluoro-4-methoxy-phenyl)acetyl]amino]-3-[(2S)-2-methylheptyl]thiourea Formula: C18H28FN3O2S MolecularWeight: 369.497223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CNC(=S)NNC(=O)CC1=CC(=C(C=C1)OC)F

Isomeric SMILES

CCCCC[C@H](C)CNC(=S)NNC(=O)CC1=CC(=C(C=C1)OC)F

InChI

InChI=1S/C18H28FN3O2S/c1-4-5-6-7-13(2)12-20-18(25)22-21-17(23)11-14-8-9-16(24-3)15(19)10-14/h8-10,13H,4-7,11-12H2,1-3H3,(H,21,23)(H2,20,22,25)/t13-/m0/s1