N-[2-methyl-5-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[2-methyl-5-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]phenyl]cyclopropanecarboxamide Openeye Name: N-[2-methyl-5-[[(E)-3-(1-naphthyl)prop-2-enoyl]carbamothioylamino]phenyl]cyclopropanecarboxamide CAS Name: N-[2-methyl-5-[[[[(E)-3-(1-naphthalenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]phenyl]cyclopropanecarboxamide IUPAC Name: N-[2-methyl-5-[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]phenyl]cyclopropanecarboxamide Traditional Name: N-[2-methyl-5-[[(E)-3-(1-naphthyl)acryloyl]thiocarbamoylamino]phenyl]cyclopropanecarboxamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC(=O)C=CC2=CC=CC3=CC=CC=C32)NC(=O)C4CC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC(=O)/C=C/C2=CC=CC3=CC=CC=C32)NC(=O)C4CC4

InChI

InChI=1S/C25H23N3O2S/c1-16-9-13-20(15-22(16)27-24(30)19-10-11-19)26-25(31)28-23(29)14-12-18-7-4-6-17-5-2-3-8-21(17)18/h2-9,12-15,19H,10-11H2,1H3,(H,27,30)(H2,26,28,29,31)/b14-12+