1-[3-(4-tert-butylphenyl)propanoylamino]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[3-(4-tert-butylphenyl)propanoylamino]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[3-(4-tert-butylphenyl)propanoylamino]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[[3-(4-tert-butylphenyl)-1-oxopropyl]amino]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[3-(4-tert-butylphenyl)propanoylamino]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-[3-(4-tert-butylphenyl)propanoylamino]-3-(4-fluorobenzyl)thiourea Formula: C21H26FN3OS MolecularWeight: 387.514043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CCC(=O)NNC(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CCC(=O)NNC(=S)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C21H26FN3OS/c1-21(2,3)17-9-4-15(5-10-17)8-13-19(26)24-25-20(27)23-14-16-6-11-18(22)12-7-16/h4-7,9-12H,8,13-14H2,1-3H3,(H,24,26)(H2,23,25,27)