1-[2,6-bis(phenylsulfanyl)pyridin-3-yl]-3-(4-methylphenyl)sulfonyl-urea

Systemtic Name: 1-[2,6-bis(phenylsulfanyl)pyridin-3-yl]-3-(4-methylphenyl)sulfonyl-urea Openeye Name: 1-[2,6-bis(phenylsulfanyl)-3-pyridyl]-3-(p-tolylsulfonyl)urea CAS Name: 1-[2,6-bis(phenylthio)-3-pyridinyl]-3-(4-methylphenyl)sulfonylurea IUPAC Name: 1-[2,6-bis(phenylsulfanyl)pyridin-3-yl]-3-(4-methylphenyl)sulfonylurea Traditional Name: 1-[2,6-bis(phenylthio)-3-pyridyl]-3-tosyl-urea Formula: C25H21N3O3S3 MolecularWeight: 507.64754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=C(N=C(C=C2)SC3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=C(N=C(C=C2)SC3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C25H21N3O3S3/c1-18-12-14-21(15-13-18)34(30,31)28-25(29)26-22-16-17-23(32-19-8-4-2-5-9-19)27-24(22)33-20-10-6-3-7-11-20/h2-17H,1H3,(H2,26,28,29)