2-(2-fluorophenyl)sulfanylethyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate

Systemtic Name: 2-(2-fluorophenyl)sulfanylethyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: 2-(2-fluorophenyl)sulfanylethyl 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid 2-[(2-fluorophenyl)thio]ethyl ester IUPAC Name: 2-(2-fluorophenyl)sulfanylethyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid 2-[(2-fluorophenyl)thio]ethyl ester Formula: C20H23FN2O3S MolecularWeight: 390.471623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCCSC2=CC=CC=C2F

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCCSC2=CC=CC=C2F

InChI

InChI=1S/C20H23FN2O3S/c1-14(2)23-20(25)22-13-15-7-9-16(10-8-15)19(24)26-11-12-27-18-6-4-3-5-17(18)21/h3-10,14H,11-13H2,1-2H3,(H2,22,23,25)