1-[(3-methyl-5-methylsulfonyl-pyridin-2-yl)amino]-3-(3-phenoxypropyl)urea

Systemtic Name: 1-[(3-methyl-5-methylsulfonyl-pyridin-2-yl)amino]-3-(3-phenoxypropyl)urea Openeye Name: 1-[(3-methyl-5-methylsulfonyl-2-pyridyl)amino]-3-(3-phenoxypropyl)urea CAS Name: 1-[(3-methyl-5-methylsulfonyl-2-pyridinyl)amino]-3-(3-phenoxypropyl)urea IUPAC Name: 1-[(3-methyl-5-methylsulfonylpyridin-2-yl)amino]-3-(3-phenoxypropyl)urea Traditional Name: 1-[(5-mesyl-3-methyl-2-pyridyl)amino]-3-(3-phenoxypropyl)urea Formula: C17H22N4O4S MolecularWeight: 378.44598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN=C1NNC(=O)NCCCOC2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CN=C1NNC(=O)NCCCOC2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C17H22N4O4S/c1-13-11-15(26(2,23)24)12-19-16(13)20-21-17(22)18-9-6-10-25-14-7-4-3-5-8-14/h3-5,7-8,11-12H,6,9-10H2,1-2H3,(H,19,20)(H2,18,21,22)