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

Systemtic Name: 1-cycloheptyl-3-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-1-[(4-phenylphenyl)methyl]urea Openeye Name: 1-cycloheptyl-3-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridyl]-1-[(4-phenylphenyl)methyl]urea CAS Name: 1-cycloheptyl-3-[6-methyl-2,4-bis(methylthio)-3-pyridinyl]-1-[(4-phenylphenyl)methyl]urea IUPAC Name: 1-cycloheptyl-3-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-1-[(4-phenylphenyl)methyl]urea Traditional Name: 1-cycloheptyl-3-[6-methyl-2,4-bis(methylthio)-3-pyridyl]-1-(4-phenylbenzyl)urea Formula: C29H35N3OS2 MolecularWeight: 505.7377

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)SC)NC(=O)N(CC2=CC=C(C=C2)C3=CC=CC=C3)C4CCCCCC4)SC

Isomeric SMILES

CC1=NC(=C(C(=C1)SC)NC(=O)N(CC2=CC=C(C=C2)C3=CC=CC=C3)C4CCCCCC4)SC

InChI

InChI=1S/C29H35N3OS2/c1-21-19-26(34-2)27(28(30-21)35-3)31-29(33)32(25-13-9-4-5-10-14-25)20-22-15-17-24(18-16-22)23-11-7-6-8-12-23/h6-8,11-12,15-19,25H,4-5,9-10,13-14,20H2,1-3H3,(H,31,33)