N-[4-[[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[[[[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[[[(E)-3-(4-methoxyphenyl)acryloyl]thiocarbamoylamino]carbamoyl]phenyl]cyclopropanecarboxamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3CC3

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3CC3

InChI

InChI=1S/C22H22N4O4S/c1-30-18-11-2-14(3-12-18)4-13-19(27)24-22(31)26-25-21(29)16-7-9-17(10-8-16)23-20(28)15-5-6-15/h2-4,7-13,15H,5-6H2,1H3,(H,23,28)(H,25,29)(H2,24,26,27,31)/b13-4+