1-(2,6-dimethylphenyl)-3-[1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]pentan-2-yl]urea

Systemtic Name: 1-(2,6-dimethylphenyl)-3-[1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]pentan-2-yl]urea Openeye Name: 1-[1-(4-benzylpiperazine-1-carbonyl)butyl]-3-(2,6-dimethylphenyl)urea CAS Name: 1-(2,6-dimethylphenyl)-3-[1-oxo-1-[4-(phenylmethyl)-1-piperazinyl]pentan-2-yl]urea IUPAC Name: 1-[1-(4-benzylpiperazin-1-yl)-1-oxopentan-2-yl]-3-(2,6-dimethylphenyl)urea Traditional Name: 1-[1-(4-benzylpiperazine-1-carbonyl)butyl]-3-(2,6-dimethylphenyl)urea Formula: C25H34N4O2 MolecularWeight: 422.56306

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)NC(=O)NC3=C(C=CC=C3C)C

Isomeric SMILES

CCCC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)NC(=O)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C25H34N4O2/c1-4-9-22(26-25(31)27-23-19(2)10-8-11-20(23)3)24(30)29-16-14-28(15-17-29)18-21-12-6-5-7-13-21/h5-8,10-13,22H,4,9,14-18H2,1-3H3,(H2,26,27,31)