N-[4-[[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]carbamoyl]phenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]carbamoyl]phenyl]cyclohexanecarboxamide Openeye Name: N-[4-[[[(E)-3-(1-naphthyl)prop-2-enoyl]carbamothioylamino]carbamoyl]phenyl]cyclohexanecarboxamide CAS Name: N-[4-[[[[[(E)-3-(1-naphthalenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[[[(E)-3-naphthalen-1-ylprop-2-enoyl]carbamothioylamino]carbamoyl]phenyl]cyclohexanecarboxamide Traditional Name: N-[4-[[[(E)-3-(1-naphthyl)acryloyl]thiocarbamoylamino]carbamoyl]phenyl]cyclohexanecarboxamide Formula: C28H28N4O3S MolecularWeight: 500.61192

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C=CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)/C=C/C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H28N4O3S/c33-25(18-15-20-11-6-10-19-7-4-5-12-24(19)20)30-28(36)32-31-27(35)22-13-16-23(17-14-22)29-26(34)21-8-2-1-3-9-21/h4-7,10-18,21H,1-3,8-9H2,(H,29,34)(H,31,35)(H2,30,32,33,36)/b18-15+