1-[(4-methylphenyl)methyl]-3-[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]urea

Systemtic Name: 1-[(4-methylphenyl)methyl]-3-[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]urea Openeye Name: 1-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxo-ethyl]-3-(p-tolylmethyl)urea CAS Name: 1-[2-[4-(benzenesulfonyl)-1-piperazinyl]-2-oxoethyl]-3-[(4-methylphenyl)methyl]urea IUPAC Name: 1-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethyl]-3-[(4-methylphenyl)methyl]urea Traditional Name: 1-[2-(4-besylpiperazino)-2-keto-ethyl]-3-(4-methylbenzyl)urea Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)NCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)NCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

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