1-methyl-3-(4-methylphenyl)sulfonyl-1-(4-pyrrolidin-1-ylpyridin-2-yl)urea

Systemtic Name: 1-methyl-3-(4-methylphenyl)sulfonyl-1-(4-pyrrolidin-1-ylpyridin-2-yl)urea Openeye Name: 1-methyl-3-(p-tolylsulfonyl)-1-(4-pyrrolidin-1-yl-2-pyridyl)urea CAS Name: 1-methyl-3-(4-methylphenyl)sulfonyl-1-[4-(1-pyrrolidinyl)-2-pyridinyl]urea IUPAC Name: 1-methyl-3-(4-methylphenyl)sulfonyl-1-(4-pyrrolidin-1-ylpyridin-2-yl)urea Traditional Name: 1-methyl-1-(4-pyrrolidino-2-pyridyl)-3-tosyl-urea Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N(C)C2=NC=CC(=C2)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N(C)C2=NC=CC(=C2)N3CCCC3

InChI

InChI=1S/C18H22N4O3S/c1-14-5-7-16(8-6-14)26(24,25)20-18(23)21(2)17-13-15(9-10-19-17)22-11-3-4-12-22/h5-10,13H,3-4,11-12H2,1-2H3,(H,20,23)