1-[[4-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl]methyl]urea

Systemtic Name: 1-[[4-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl]methyl]urea Openeye Name: [4-[4-(3,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]methylurea CAS Name: [4-[[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]phenyl]methylurea IUPAC Name: [4-[4-(3,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]methylurea Traditional Name: [4-[4-(3,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]benzyl]urea Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O4S/c1-15-3-8-19(13-16(15)2)30(28,29)25-11-9-24(10-12-25)20(26)18-6-4-17(5-7-18)14-23-21(22)27/h3-8,13H,9-12,14H2,1-2H3,(H3,22,23,27)