methyl 2-[(2-ethoxyphenyl)carbamothioylamino]-3-(4-fluorophenyl)propanoate

Systemtic Name: methyl 2-[(2-ethoxyphenyl)carbamothioylamino]-3-(4-fluorophenyl)propanoate Openeye Name: methyl 2-[(2-ethoxyphenyl)carbamothioylamino]-3-(4-fluorophenyl)propanoate CAS Name: 2-[[(2-ethoxyanilino)-sulfanylidenemethyl]amino]-3-(4-fluorophenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(2-ethoxyphenyl)carbamothioylamino]-3-(4-fluorophenyl)propanoate Traditional Name: 3-(4-fluorophenyl)-2-(o-phenetylthiocarbamoylamino)propionic acid methyl ester Formula: C19H21FN2O3S MolecularWeight: 376.445043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)NC(CC2=CC=C(C=C2)F)C(=O)OC

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)NC(CC2=CC=C(C=C2)F)C(=O)OC

InChI

InChI=1S/C19H21FN2O3S/c1-3-25-17-7-5-4-6-15(17)21-19(26)22-16(18(23)24-2)12-13-8-10-14(20)11-9-13/h4-11,16H,3,12H2,1-2H3,(H2,21,22,26)