1-[5-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentanoyl]-2-methylsulfinyl-phenyl]urea

Systemtic Name: 1-[5-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentanoyl]-2-methylsulfinyl-phenyl]urea Openeye Name: [5-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentanoyl]-2-methylsulfinyl-phenyl]urea CAS Name: [5-[5-[4-(2-methoxyphenyl)-1-piperazinyl]-1-oxopentyl]-2-methylsulfinylphenyl]urea IUPAC Name: [5-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentanoyl]-2-methylsulfinylphenyl]urea Traditional Name: [5-[5-[4-(2-methoxyphenyl)piperazino]pentanoyl]-2-methylsulfinyl-phenyl]urea Formula: C24H32N4O4S MolecularWeight: 472.60028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCCC(=O)C3=CC(=C(C=C3)S(=O)C)NC(=O)N

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCCC(=O)C3=CC(=C(C=C3)S(=O)C)NC(=O)N

InChI

InChI=1S/C24H32N4O4S/c1-32-22-9-4-3-7-20(22)28-15-13-27(14-16-28)12-6-5-8-21(29)18-10-11-23(33(2)31)19(17-18)26-24(25)30/h3-4,7,9-11,17H,5-6,8,12-16H2,1-2H3,(H3,25,26,30)