1-(3-chloranyl-4-methyl-phenyl)-3-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]urea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]urea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]urea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[4-[4-(2-ethyl-1-oxobutyl)-1-piperazinyl]phenyl]urea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]urea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[4-[4-(2-ethylbutanoyl)piperazino]phenyl]urea Formula: C24H31ClN4O2 MolecularWeight: 442.98154

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)C)Cl

Isomeric SMILES

CCC(CC)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)C)Cl

InChI

InChI=1S/C24H31ClN4O2/c1-4-18(5-2)23(30)29-14-12-28(13-15-29)21-10-8-19(9-11-21)26-24(31)27-20-7-6-17(3)22(25)16-20/h6-11,16,18H,4-5,12-15H2,1-3H3,(H2,26,27,31)