3-[1-(4-methylpiperazin-1-yl)-4-oxidanyl-1-oxidanylidene-butan-2-yl]-1-phenethyl-1-(2-sulfanylethyl)urea

Systemtic Name: 3-[1-(4-methylpiperazin-1-yl)-4-oxidanyl-1-oxidanylidene-butan-2-yl]-1-phenethyl-1-(2-sulfanylethyl)urea Openeye Name: 3-[3-hydroxy-1-(4-methylpiperazine-1-carbonyl)propyl]-1-phenethyl-1-(2-sulfanylethyl)urea CAS Name: 3-[4-hydroxy-1-(4-methyl-1-piperazinyl)-1-oxobutan-2-yl]-1-(2-mercaptoethyl)-1-phenethylurea IUPAC Name: 3-[4-hydroxy-1-(4-methylpiperazin-1-yl)-1-oxobutan-2-yl]-1-phenethyl-1-(2-sulfanylethyl)urea Traditional Name: 3-[3-hydroxy-1-(4-methylpiperazine-1-carbonyl)propyl]-1-(2-mercaptoethyl)-1-phenethyl-urea Formula: C20H32N4O3S MolecularWeight: 408.55808

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C(CCO)NC(=O)N(CCC2=CC=CC=C2)CCS

Isomeric SMILES

CN1CCN(CC1)C(=O)C(CCO)NC(=O)N(CCC2=CC=CC=C2)CCS

InChI

InChI=1S/C20H32N4O3S/c1-22-10-12-23(13-11-22)19(26)18(8-15-25)21-20(27)24(14-16-28)9-7-17-5-3-2-4-6-17/h2-6,18,25,28H,7-16H2,1H3,(H,21,27)