1-cycloheptyl-3-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-1-(naphthalen-2-ylmethyl)urea

Systemtic Name: 1-cycloheptyl-3-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-1-(naphthalen-2-ylmethyl)urea Openeye Name: 1-cycloheptyl-3-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridyl]-1-(2-naphthylmethyl)urea CAS Name: 1-cycloheptyl-3-[6-methyl-2,4-bis(methylthio)-3-pyridinyl]-1-(2-naphthalenylmethyl)urea IUPAC Name: 1-cycloheptyl-3-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-1-(naphthalen-2-ylmethyl)urea Traditional Name: 1-cycloheptyl-3-[6-methyl-2,4-bis(methylthio)-3-pyridyl]-1-(2-naphthylmethyl)urea Formula: C27H33N3OS2 MolecularWeight: 479.70042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)SC)NC(=O)N(CC2=CC3=CC=CC=C3C=C2)C4CCCCCC4)SC

Isomeric SMILES

CC1=NC(=C(C(=C1)SC)NC(=O)N(CC2=CC3=CC=CC=C3C=C2)C4CCCCCC4)SC

InChI

InChI=1S/C27H33N3OS2/c1-19-16-24(32-2)25(26(28-19)33-3)29-27(31)30(23-12-6-4-5-7-13-23)18-20-14-15-21-10-8-9-11-22(21)17-20/h8-11,14-17,23H,4-7,12-13,18H2,1-3H3,(H,29,31)