1-phenyl-3-[1,1,4,4-tetradeuterio-4-(phenylcarbamoylamino)butyl]urea

Systemtic Name: 1-phenyl-3-[1,1,4,4-tetradeuterio-4-(phenylcarbamoylamino)butyl]urea Openeye Name: 1-phenyl-3-[1,1,4,4-tetradeuterio-4-(phenylcarbamoylamino)butyl]urea CAS Name: 1-[4-[[anilino(oxo)methyl]amino]-1,1,4,4-tetradeuteriobutyl]-3-phenylurea IUPAC Name: 1-phenyl-3-[1,1,4,4-tetradeuterio-4-(phenylcarbamoylamino)butyl]urea Traditional Name: 1-phenyl-3-[1,1,4,4-tetradeuterio-4-(phenylcarbamoylamino)butyl]urea Formula: C18H22N4O2 MolecularWeight: 330.417527

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NCCCCNC(=O)NC2=CC=CC=C2

Isomeric SMILES

[2H]C([2H])(CCC([2H])([2H])NC(=O)NC1=CC=CC=C1)NC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C18H22N4O2/c23-17(21-15-9-3-1-4-10-15)19-13-7-8-14-20-18(24)22-16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2,(H2,19,21,23)(H2,20,22,24)/i13D2,14D2