3-[4-[(Z)-N-[(4-fluorophenyl)carbamothioylamino]-C-methyl-carbonimidoyl]-5-methyl-furan-2-yl]propanoate

Systemtic Name: 3-[4-[(Z)-N-[(4-fluorophenyl)carbamothioylamino]-C-methyl-carbonimidoyl]-5-methyl-furan-2-yl]propanoate Openeye Name: 3-[4-[(Z)-N-[(4-fluorophenyl)carbamothioylamino]-C-methyl-carbonimidoyl]-5-methyl-2-furyl]propanoate CAS Name: 3-[4-[(1Z)-1-[[(4-fluoroanilino)-sulfanylidenemethyl]hydrazinylidene]ethyl]-5-methyl-2-furanyl]propanoate IUPAC Name: 3-[4-[(Z)-N-[(4-fluorophenyl)carbamothioylamino]-C-methylcarbonimidoyl]-5-methylfuran-2-yl]propanoate Traditional Name: 3-[4-[(Z)-N-[(4-fluorophenyl)thiocarbamoylamino]-C-methyl-carbonimidoyl]-5-methyl-2-furyl]propionate Formula: C17H17FN3O3S- MolecularWeight: 362.398583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CCC(=O)[O-])C(=NNC(=S)NC2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=C(C=C(O1)CCC(=O)[O-])/C(=N\NC(=S)NC2=CC=C(C=C2)F)/C

InChI

InChI=1S/C17H18FN3O3S/c1-10(15-9-14(24-11(15)2)7-8-16(22)23)20-21-17(25)19-13-5-3-12(18)4-6-13/h3-6,9H,7-8H2,1-2H3,(H,22,23)(H2,19,21,25)/p-1/b20-10-