1-naphthalen-1-yl-3-[(1S,2R)-2-(naphthalen-1-ylcarbamothioylamino)cyclohexyl]thiourea

Systemtic Name: 1-naphthalen-1-yl-3-[(1S,2R)-2-(naphthalen-1-ylcarbamothioylamino)cyclohexyl]thiourea Openeye Name: 1-(1-naphthyl)-3-[(1S,2R)-2-(1-naphthylcarbamothioylamino)cyclohexyl]thiourea CAS Name: 1-(1-naphthalenyl)-3-[(1S,2R)-2-[[(1-naphthalenylamino)-sulfanylidenemethyl]amino]cyclohexyl]thiourea IUPAC Name: 1-naphthalen-1-yl-3-[(1S,2R)-2-(naphthalen-1-ylcarbamothioylamino)cyclohexyl]thiourea Traditional Name: 1-(1-naphthyl)-3-[(1S,2R)-2-(1-naphthylthiocarbamoylamino)cyclohexyl]thiourea Formula: C28H28N4S2 MolecularWeight: 484.67872

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)NC(=S)NC2=CC=CC3=CC=CC=C32)NC(=S)NC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CC[C@@H]([C@@H](C1)NC(=S)NC2=CC=CC3=CC=CC=C32)NC(=S)NC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H28N4S2/c33-27(29-23-17-7-11-19-9-1-3-13-21(19)23)31-25-15-5-6-16-26(25)32-28(34)30-24-18-8-12-20-10-2-4-14-22(20)24/h1-4,7-14,17-18,25-26H,5-6,15-16H2,(H2,29,31,33)(H2,30,32,34)/t25-,26+