1-(2-cyclohexylcyclopropyl)-3-(4-pyridin-4-ylsulfanylnaphthalen-1-yl)urea

Systemtic Name: 1-(2-cyclohexylcyclopropyl)-3-(4-pyridin-4-ylsulfanylnaphthalen-1-yl)urea Openeye Name: 1-(2-cyclohexylcyclopropyl)-3-[4-(4-pyridylsulfanyl)-1-naphthyl]urea CAS Name: 1-(2-cyclohexylcyclopropyl)-3-[4-(pyridin-4-ylthio)-1-naphthalenyl]urea IUPAC Name: 1-(2-cyclohexylcyclopropyl)-3-(4-pyridin-4-ylsulfanylnaphthalen-1-yl)urea Traditional Name: 1-(2-cyclohexylcyclopropyl)-3-[4-(4-pyridylthio)-1-naphthyl]urea Formula: C25H27N3OS MolecularWeight: 417.56638

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CC2NC(=O)NC3=CC=C(C4=CC=CC=C43)SC5=CC=NC=C5

Isomeric SMILES

C1CCC(CC1)C2CC2NC(=O)NC3=CC=C(C4=CC=CC=C43)SC5=CC=NC=C5

InChI

InChI=1S/C25H27N3OS/c29-25(28-23-16-21(23)17-6-2-1-3-7-17)27-22-10-11-24(20-9-5-4-8-19(20)22)30-18-12-14-26-15-13-18/h4-5,8-15,17,21,23H,1-3,6-7,16H2,(H2,27,28,29)