1-[2,4-bis(ethylsulfanyl)-6-methyl-pyridin-3-yl]-3-(2-naphthalen-1-ylheptyl)urea

Systemtic Name: 1-[2,4-bis(ethylsulfanyl)-6-methyl-pyridin-3-yl]-3-(2-naphthalen-1-ylheptyl)urea Openeye Name: 1-[2,4-bis(ethylsulfanyl)-6-methyl-3-pyridyl]-3-[2-(1-naphthyl)heptyl]urea CAS Name: 1-[2,4-bis(ethylthio)-6-methyl-3-pyridinyl]-3-[2-(1-naphthalenyl)heptyl]urea IUPAC Name: 1-[2,4-bis(ethylsulfanyl)-6-methylpyridin-3-yl]-3-(2-naphthalen-1-ylheptyl)urea Traditional Name: 1-[2,4-bis(ethylthio)-6-methyl-3-pyridyl]-3-[2-(1-naphthyl)heptyl]urea Formula: C28H37N3OS2 MolecularWeight: 495.74288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CNC(=O)NC1=C(N=C(C=C1SCC)C)SCC)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCCCCC(CNC(=O)NC1=C(N=C(C=C1SCC)C)SCC)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C28H37N3OS2/c1-5-8-9-14-22(24-17-12-15-21-13-10-11-16-23(21)24)19-29-28(32)31-26-25(33-6-2)18-20(4)30-27(26)34-7-3/h10-13,15-18,22H,5-9,14,19H2,1-4H3,(H2,29,31,32)