1-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-1-phenyl-propyl]urea

Systemtic Name: 1-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-1-phenyl-propyl]urea Openeye Name: [3-oxo-1-phenyl-3-[4-(p-tolylsulfonyl)piperazin-1-yl]propyl]urea CAS Name: [3-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-3-oxo-1-phenylpropyl]urea IUPAC Name: [3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-oxo-1-phenylpropyl]urea Traditional Name: [3-keto-1-phenyl-3-(4-tosylpiperazino)propyl]urea Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC(C3=CC=CC=C3)NC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC(C3=CC=CC=C3)NC(=O)N

InChI

InChI=1S/C21H26N4O4S/c1-16-7-9-18(10-8-16)30(28,29)25-13-11-24(12-14-25)20(26)15-19(23-21(22)27)17-5-3-2-4-6-17/h2-10,19H,11-15H2,1H3,(H3,22,23,27)