1-(3-fluoranyl-4-methyl-phenyl)-3-[[4-(piperidin-1-ylmethyl)phenyl]methyl]thiourea

Systemtic Name: 1-(3-fluoranyl-4-methyl-phenyl)-3-[[4-(piperidin-1-ylmethyl)phenyl]methyl]thiourea Openeye Name: 1-(3-fluoro-4-methyl-phenyl)-3-[[4-(1-piperidylmethyl)phenyl]methyl]thiourea CAS Name: 1-(3-fluoro-4-methylphenyl)-3-[[4-(1-piperidinylmethyl)phenyl]methyl]thiourea IUPAC Name: 1-(3-fluoro-4-methylphenyl)-3-[[4-(piperidin-1-ylmethyl)phenyl]methyl]thiourea Traditional Name: 1-(3-fluoro-4-methyl-phenyl)-3-[4-(piperidinomethyl)benzyl]thiourea Formula: C21H26FN3S MolecularWeight: 371.514643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCC2=CC=C(C=C2)CN3CCCCC3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCC2=CC=C(C=C2)CN3CCCCC3)F

InChI

InChI=1S/C21H26FN3S/c1-16-5-10-19(13-20(16)22)24-21(26)23-14-17-6-8-18(9-7-17)15-25-11-3-2-4-12-25/h5-10,13H,2-4,11-12,14-15H2,1H3,(H2,23,24,26)