N-[4-[[3-(4-fluorophenyl)prop-2-enoylcarbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[[3-(4-fluorophenyl)prop-2-enoylcarbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[[3-(4-fluorophenyl)prop-2-enoylcarbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[[[[[3-(4-fluorophenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[[3-(4-fluorophenyl)prop-2-enoylcarbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[[[3-(4-fluorophenyl)acryloyl]thiocarbamoylamino]carbamoyl]phenyl]cyclopropanecarboxamide Formula: C21H19FN4O3S MolecularWeight: 426.463963

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C=CC3=CC=C(C=C3)F

Isomeric SMILES

C1CC1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C=CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H19FN4O3S/c22-16-8-1-13(2-9-16)3-12-18(27)24-21(30)26-25-20(29)15-6-10-17(11-7-15)23-19(28)14-4-5-14/h1-3,6-12,14H,4-5H2,(H,23,28)(H,25,29)(H2,24,26,27,30)