1-[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-3-(pyridin-4-ylcarbonylamino)urea

Systemtic Name: 1-[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-3-(pyridin-4-ylcarbonylamino)urea Openeye Name: 1-[1-(p-tolylsulfonyl)pyrrolidin-2-yl]-3-(pyridine-4-carbonylamino)urea CAS Name: 1-[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-3-[[oxo(pyridin-4-yl)methyl]amino]urea IUPAC Name: 1-[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-3-(pyridine-4-carbonylamino)urea Traditional Name: 1-isonicotinamido-3-(1-tosylpyrrolidin-2-yl)urea Formula: C18H21N5O4S MolecularWeight: 403.45544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2NC(=O)NNC(=O)C3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2NC(=O)NNC(=O)C3=CC=NC=C3

InChI

InChI=1S/C18H21N5O4S/c1-13-4-6-15(7-5-13)28(26,27)23-12-2-3-16(23)20-18(25)22-21-17(24)14-8-10-19-11-9-14/h4-11,16H,2-3,12H2,1H3,(H,21,24)(H2,20,22,25)